data_1t4l_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 1t4l _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.507 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.206 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.483 ' HE1' ' N ' ' B' ' 369' ' ' ASN . 3.0 ttp -32.49 -52.21 0.29 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.507 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.483 ' N ' ' HE1' ' B' ' 368' ' ' MET . 32.0 m-20 -58.65 -49.79 76.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.224 179.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.543 ' CB ' ' HB1' ' B' ' 428' ' ' ALA . . . -54.86 -79.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.275 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.467 ' C ' ' O ' ' B' ' 370' ' ' ALA . 0.2 OUTLIER -29.33 -45.15 0.04 OUTLIER 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.031 0.443 . . . . 0.0 111.016 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.525 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -61.64 -61.64 2.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.323 179.551 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.522 ' HG3' ' CB ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -40.93 -34.55 0.42 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.221 0.534 . . . . 0.0 110.137 179.309 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' B' ' 379' ' ' GLY . 2.6 mt -68.29 -80.9 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.211 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.88 27.79 0.85 Allowed 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -178.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.525 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 1.1 p -135.92 -31.57 0.92 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.241 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 1.1 mm? -109.39 -27.85 9.26 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.485 ' CG1' HD22 ' B' ' 438' ' ' LEU . 19.0 mm -129.5 -62.5 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.804 -179.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.54 ' N ' ' O ' ' B' ' 374' ' ' LEU . . . -32.64 102.72 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.732 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.528 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 10.1 p90 -115.04 177.73 4.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.888 0.375 . . . . 0.0 110.831 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.448 ' O ' ' HB3' ' B' ' 382' ' ' SER . . . -65.99 118.14 9.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.213 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.448 ' HB3' ' O ' ' B' ' 381' ' ' ALA . 8.4 t 79.13 45.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.224 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.513 ' O ' ' CB ' ' B' ' 384' ' ' ARG . 0.1 OUTLIER -95.39 -42.16 8.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.809 0.338 . . . . 0.0 110.706 179.675 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.513 ' CB ' ' O ' ' B' ' 383' ' ' LEU . 3.8 tpm_? 84.56 -6.16 0.99 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.106 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.603 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 4.5 tt -36.02 129.5 0.66 Allowed 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.778 0.323 . . . . 0.0 110.583 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.449 ' N ' HD23 ' B' ' 385' ' ' LEU . 3.9 p-80 -161.22 147.37 14.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.647 0.737 . . . . 0.0 112.862 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.484 ' OH ' ' HA ' ' B' ' 428' ' ' ALA . 11.9 m-85 -105.12 141.95 35.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.97 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -121.72 123.29 69.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.091 0.472 . . . . 0.0 111.289 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.15 130.41 38.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.629 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.566 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 28.0 m -141.36 144.9 25.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.964 0.411 . . . . 0.0 110.915 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.566 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 7.9 tptt 95.68 56.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.531 -179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' B' ' 391' ' ' LYS . 4.2 mmpt? -31.21 107.41 0.25 Allowed Pre-proline 0 N--CA 1.462 0.154 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.206 -179.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.491 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 4.3 Cg_exo -44.98 159.53 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.799 2.333 . . . . 0.0 113.353 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 16.6 p -128.12 158.27 38.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.972 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -86.28 13.83 7.45 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.597 179.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 3.0 m -136.96 14.05 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.082 177.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 166.45 61.56 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 114.496 -1.229 . . . . 0.0 108.797 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.491 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 96.4 Cg_exo -42.8 -32.18 2.45 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.225 2.617 . . . . 0.0 113.086 -179.034 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.587 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.8 OUTLIER -30.67 127.21 0.15 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.022 -178.761 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 400' ' ' SER . . . . . 0.415 ' O ' HG23 ' B' ' 416' ' ' VAL . 47.7 t -136.55 166.92 22.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.848 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.457 HG21 ' O ' ' B' ' 390' ' ' VAL . 15.3 tt -122.51 161.98 22.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.105 0.478 . . . . 0.0 111.495 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.482 ' CG2' ' C ' ' B' ' 423' ' ' ALA . 0.1 OUTLIER -128.68 143.76 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.943 -179.624 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.439 ' HA ' HG22 ' B' ' 414' ' ' THR . 0.6 OUTLIER -110.69 125.78 53.84 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.774 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 412' ' ' LEU . 41.3 t -106.18 107.21 18.1 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.529 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -147.65 -171.31 3.78 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.196 0.522 . . . . 0.0 111.536 -179.131 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.603 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.1 OUTLIER -135.85 147.5 28.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.157 -179.395 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . 0.421 ' HA3' ' HG2' ' B' ' 384' ' ' ARG . . . -35.34 -28.8 0.01 OUTLIER Glycine 0 C--N 1.332 0.311 0 CA-C-N 115.488 -0.778 . . . . 0.0 113.62 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . 0.463 ' N ' ' O ' ' B' ' 406' ' ' VAL . 59.3 m-20 -70.31 -3.17 15.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.877 0.37 . . . . 0.0 111.099 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 82.26 33.06 26.9 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.783 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.529 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 19.3 m -116.18 118.38 32.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.587 0.232 . . . . 0.0 111.375 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.465 ' HA ' ' HB3' ' B' ' 405' ' ' ARG . 70.9 t -92.32 111.9 25.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.156 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.535 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.5 OUTLIER -67.37 -36.21 80.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.364 -0.38 . . . . 0.0 109.978 179.164 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.445 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . -175.29 -152.57 9.45 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.518 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.45 HG23 ' O ' ' B' ' 402' ' ' VAL . 0.1 OUTLIER -159.92 174.17 14.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.475 0.179 . . . . 0.0 110.701 -179.84 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.463 ' CA ' ' HG2' ' B' ' 426' ' ' ARG . . . -169.03 128.51 1.7 Allowed Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.133 -1.032 . . . . 0.0 112.877 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.415 HG23 ' O ' ' B' ' 400' ' ' SER . 7.1 p -123.49 155.59 29.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.853 0.358 . . . . 0.0 110.411 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.587 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -164.43 169.22 39.13 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.554 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.519 ' N ' HD11 ' B' ' 422' ' ' ILE . 8.1 ptm180 -79.98 -39.95 29.0 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 117.312 0.556 . . . . 0.0 111.532 -179.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.635 ' O ' ' N ' ' B' ' 421' ' ' LYS . 3.0 p-10 -101.99 31.75 3.77 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.566 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.79 -46.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.635 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -44.42 -55.17 5.23 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 118.796 0.725 . . . . 0.0 109.806 -179.474 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.579 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -42.83 -34.26 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.571 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.194 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.566 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -68.61 -44.81 73.48 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.184 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -60.03 -62.98 5.47 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.181 -1.009 . . . . 0.0 111.676 179.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . . . . . . . . . 4.4 mp -56.73 -42.24 76.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.91 0.386 . . . . 0.0 110.393 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.579 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -56.02 -43.57 77.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.126 179.434 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.476 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -56.41 -50.51 71.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.337 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.543 ' HB1' ' CB ' ' B' ' 370' ' ' ALA . . . -55.08 -59.65 4.46 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.665 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.459 ' O ' ' HB3' ' B' ' 433' ' ' ARG . 2.9 mt-10 -50.07 -29.87 9.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.124 0.488 . . . . 0.0 109.838 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.514 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 0.8 OUTLIER -67.79 -38.12 82.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.398 179.5 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.478 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -62.69 -41.79 99.29 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.165 0.507 . . . . 0.0 110.204 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.522 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.1 OUTLIER -87.26 5.94 35.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.362 179.124 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . 0.514 ' CG ' ' O ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -89.4 11.81 18.14 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.109 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.544 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 14.4 m-20 -125.81 81.38 1.98 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.521 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 12.3 ptpt -46.93 -49.35 20.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.427 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.521 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.2 mmmm -61.22 -46.12 91.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.742 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.544 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 18.9 tmm? -63.24 -45.92 89.31 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.003 0.43 . . . . 0.0 110.076 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.485 HD22 ' CG1' ' B' ' 378' ' ' ILE . 84.3 mt -57.37 -62.42 1.78 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.915 179.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -54.03 -32.28 53.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.014 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.476 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.7 OUTLIER -57.86 -43.3 85.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.118 179.661 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -73.81 -28.31 61.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.568 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.57 -51.37 67.34 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 11.0 ttpp -63.31 -48.14 79.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.577 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -50.11 -44.93 52.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.81 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.528 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.361 179.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.855 0.359 . . . . 0.0 110.495 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.47 ' O ' ' HB2' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -40.76 -42.67 1.82 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.587 179.662 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -63.84 -36.92 85.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.521 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.51 ' N ' ' O ' ' B' ' 367' ' ' ASP . . . -68.54 -74.26 0.13 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.605 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.434 ' C ' ' O ' ' B' ' 370' ' ' ALA . 0.1 OUTLIER -37.11 -44.08 0.53 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.076 0.465 . . . . 0.0 110.274 179.67 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.554 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.6 OUTLIER -64.31 -42.65 96.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.764 179.695 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.513 ' HG3' ' HB2' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -57.34 -42.83 82.72 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.174 0.512 . . . . 0.0 110.563 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.439 ' CD2' HD13 ' B' ' 432' ' ' LEU . 0.4 OUTLIER -64.69 -72.79 0.14 Allowed 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -178.62 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 4.6 m-30 -79.54 -25.02 41.78 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -177.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -91.08 -31.71 16.15 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.872 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.533 ' O ' ' CD1' ' B' ' 378' ' ' ILE . 4.6 mm? -110.85 -13.63 14.11 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.711 -0.396 . . . . 0.0 112.056 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.533 ' CD1' ' O ' ' B' ' 377' ' ' LEU . 12.5 mm -141.99 -121.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.678 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.516 ' C ' ' O ' ' B' ' 378' ' ' ILE . . . -13.9 82.2 0.0 OUTLIER Glycine 0 C--N 1.343 0.971 0 N-CA-C 114.13 0.412 . . . . 0.0 114.13 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.551 ' CD1' ' HG2' ' B' ' 445' ' ' ARG . 0.6 OUTLIER -74.27 -58.97 2.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.764 0.316 . . . . 0.0 110.317 179.591 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.551 ' CB ' ' O ' ' B' ' 380' ' ' TYR . . . 155.28 34.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.481 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.98 16.95 0.67 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.657 0.265 . . . . 0.0 111.188 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.511 ' CD1' ' HB2' ' B' ' 385' ' ' LEU . 0.2 OUTLIER -123.87 26.16 7.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.975 0.417 . . . . 0.0 110.635 179.565 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.475 ' HG3' ' HA3' ' B' ' 407' ' ' GLY . 0.0 OUTLIER 36.79 41.28 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.15 179.858 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.588 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 1.1 tt -69.2 132.62 46.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.978 0.418 . . . . 0.0 110.752 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 -169.05 135.25 1.7 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.298 0.57 . . . . 0.0 112.194 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.558 ' OH ' ' CB ' ' B' ' 431' ' ' ALA . 2.3 m-85 -84.41 178.55 7.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.325 -0.852 . . . . 0.0 108.741 178.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.538 HG21 ' CB ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -153.6 108.57 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.297 0.57 . . . . 0.0 112.153 178.525 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 389' ' ' THR . . . . . 0.415 ' O ' HG21 ' B' ' 389' ' ' THR . 3.2 m -72.18 100.04 2.48 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.269 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.476 ' O ' HG21 ' B' ' 401' ' ' ILE . 32.6 m -107.96 148.66 11.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.234 0.54 . . . . 0.0 111.116 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.464 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 15.1 tptt 80.82 55.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.406 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.443 ' C ' ' O ' ' B' ' 391' ' ' LYS . 3.0 mmpt? -33.88 131.33 0.4 Allowed Pre-proline 0 C--N 1.332 -0.152 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.555 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.548 ' HA ' ' O ' ' B' ' 398' ' ' PRO . 52.2 Cg_exo -53.74 174.42 0.15 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.554 2.169 . . . . 0.0 112.912 -178.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.527 ' OG1' ' N ' ' B' ' 397' ' ' ASP . 3.8 p -140.99 151.4 44.11 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.512 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -76.76 -5.37 47.86 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.137 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.416 ' O ' ' OD1' ' B' ' 397' ' ' ASP . 35.7 m -125.39 9.46 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.485 0.659 . . . . 0.0 110.073 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.527 ' N ' ' OG1' ' B' ' 394' ' ' THR . 7.5 m-20 179.18 63.19 0.11 Allowed Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 114.918 -1.037 . . . . 0.0 109.687 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.548 ' O ' ' HA ' ' B' ' 393' ' ' PRO . 39.7 Cg_exo -31.27 -65.99 0.08 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.333 2.689 . . . . 0.0 112.618 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.512 ' C ' ' O ' ' B' ' 398' ' ' PRO . 14.3 m120 7.71 116.6 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 400' ' ' SER . . . . . 0.465 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 0.3 OUTLIER -134.14 149.74 51.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.577 178.503 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.528 ' HA ' ' O ' ' B' ' 415' ' ' GLY . 1.3 tp -127.36 130.09 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 121.324 0.583 . . . . 0.0 112.478 -178.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.475 HG22 ' O ' ' B' ' 423' ' ' ALA . 0.7 OUTLIER -91.47 161.44 2.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.182 179.501 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.538 ' CB ' HG21 ' B' ' 388' ' ' VAL . 0.8 OUTLIER -138.58 96.83 3.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.97 0.414 . . . . 0.0 111.239 179.348 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.484 ' O ' HG13 ' B' ' 411' ' ' VAL . 0.0 OUTLIER -77.83 112.68 14.95 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.69 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.4 ' HA ' ' O ' ' B' ' 410' ' ' THR . 35.9 ttp180 -147.05 161.84 40.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.138 0.494 . . . . 0.0 111.551 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.588 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -130.56 128.8 63.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.149 -179.184 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . 0.475 ' HA3' ' HG3' ' B' ' 384' ' ' ARG . . . -30.03 -34.48 0.01 OUTLIER Glycine 0 C--N 1.334 0.442 0 C-N-CA 121.284 -0.484 . . . . 0.0 113.686 -179.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . 0.514 ' N ' ' O ' ' B' ' 406' ' ' VAL . 6.5 m-20 -55.19 -18.51 6.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.059 0.457 . . . . 0.0 110.386 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 99.35 32.35 5.81 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.834 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.518 HG22 ' CD1' ' B' ' 412' ' ' LEU . 40.0 m -122.19 121.38 36.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.964 0.412 . . . . 0.0 111.53 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.484 HG13 ' O ' ' B' ' 404' ' ' CYS . 38.6 t -90.29 84.67 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.439 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.518 ' CD1' HG22 ' B' ' 410' ' ' THR . 0.1 OUTLIER -43.06 -23.32 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.34 -179.598 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.424 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 161.61 -174.01 38.07 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.013 -1.089 . . . . 0.0 113.044 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.46 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -143.08 171.73 13.67 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.528 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -160.7 144.06 9.58 Favored Glycine 0 C--O 1.221 -0.692 0 C-N-CA 119.779 -1.2 . . . . 0.0 113.16 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.464 ' HB ' HD12 ' B' ' 401' ' ' ILE . 5.0 p -132.86 155.01 40.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.487 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -170.3 151.65 17.03 Favored Glycine 0 N--CA 1.453 -0.187 0 C-N-CA 120.02 -1.086 . . . . 0.0 113.293 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.486 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 2.3 mtm-85 -70.51 -55.26 9.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.907 0.384 . . . . 0.0 110.499 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.607 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.2 OUTLIER -75.63 -21.65 57.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.888 179.217 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.607 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 98.14 -41.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.113 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.144 -179.291 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.596 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -52.95 -40.41 63.64 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.579 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.598 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -59.14 -35.92 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.748 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 177.355 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.513 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -68.73 -36.65 78.68 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.016 178.14 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.76 -67.14 2.15 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.952 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . . . . . . . . . 2.4 mp -53.81 -48.3 61.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 178.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.598 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -50.08 -49.57 51.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.178 179.402 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . . . . . . . . . . . -49.68 -44.63 48.01 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.52 ' O ' HD12 ' B' ' 432' ' ' LEU . . . -57.35 -68.07 0.27 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.552 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.511 ' HA ' HD12 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -43.6 -25.6 0.18 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.668 179.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.43 ' CG ' ' O ' ' B' ' 414' ' ' THR . 11.3 m-80 -79.6 -32.88 41.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.712 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.558 ' CB ' ' OH ' ' B' ' 387' ' ' TYR . . . -65.52 -40.99 93.6 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 120.87 0.367 . . . . 0.0 110.517 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.538 ' O ' ' CD1' ' B' ' 438' ' ' LEU . 0.0 OUTLIER -95.85 25.86 4.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.479 0.657 . . . . 0.0 109.905 179.032 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -96.38 -8.83 31.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.087 179.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -101.16 96.68 7.37 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.788 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.523 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 4.4 ptpp? -51.78 -51.11 58.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.259 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.523 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 8.6 mmtt -56.25 -50.12 72.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.98 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.467 ' SD ' ' CD1' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -66.61 -43.49 84.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.93 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.538 ' CD1' ' O ' ' B' ' 432' ' ' LEU . 35.8 mt -61.72 -55.73 27.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.22 0.534 . . . . 0.0 111.103 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . 0.479 ' O ' ' HG3' ' B' ' 443' ' ' LYS . 20.2 t70 -65.39 -27.35 68.49 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.169 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -59.79 -47.43 85.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.949 -0.568 . . . . 0.0 109.994 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.468 ' CD1' HD23 ' B' ' 383' ' ' LEU . 60.8 m-85 -75.02 -35.43 61.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.592 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -48.57 -51.85 25.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.947 0.403 . . . . 0.0 110.075 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . 0.479 ' HG3' ' O ' ' B' ' 439' ' ' ASP . 0.0 OUTLIER -72.65 -46.93 51.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.873 179.035 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.459 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -53.69 -19.18 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.697 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.551 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.808 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.9 OUTLIER . . . . . 0 C--O 1.233 0.201 0 CA-C-O 120.888 0.375 . . . . 0.0 110.12 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.501 ' HA ' ' HD2' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -34.59 -45.56 0.25 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.429 179.772 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -59.39 -48.01 83.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.509 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.534 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -62.33 -75.28 0.08 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.581 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.501 ' HD2' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -31.58 -41.92 0.05 OUTLIER 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.105 -179.673 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.58 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.4 OUTLIER -65.44 -45.59 83.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.346 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.534 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -58.91 -39.58 81.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.177 0.513 . . . . 0.0 111.153 -179.792 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.482 HD11 ' CB ' ' B' ' 431' ' ' ALA . 1.3 mm? -67.66 -71.09 0.22 Allowed 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . 0.487 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-30 -87.37 5.88 36.45 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -177.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.58 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -122.56 -20.35 6.04 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.103 179.321 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 0.8 OUTLIER -116.15 -27.42 6.9 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.453 179.75 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.522 HG13 ' CD2' ' B' ' 438' ' ' LEU . 3.7 mm -142.07 33.58 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.112 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.487 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -122.28 86.27 0.39 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.72 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.53 ' CD2' ' HD3' ' B' ' 445' ' ' ARG . 5.1 p90 -97.86 167.63 10.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.726 0.298 . . . . 0.0 110.491 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.55 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -66.9 114.86 6.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.916 0.389 . . . . 0.0 111.714 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.55 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.4 p 90.42 44.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.881 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.507 ' CD1' ' O ' ' B' ' 378' ' ' ILE . 1.0 OUTLIER -92.61 -40.41 10.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.939 0.4 . . . . 0.0 110.684 179.657 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.446 ' CB ' ' O ' ' B' ' 383' ' ' LEU . 2.0 tpt180 81.78 -8.95 1.28 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.106 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.582 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 7.9 tt -40.83 136.02 1.53 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.493 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -164.11 148.85 10.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.541 0.686 . . . . 0.0 112.577 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.496 ' HA ' ' O ' ' B' ' 403' ' ' GLU . 2.8 m-85 -101.23 141.95 33.37 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.989 179.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.489 HG21 ' HB2' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -121.25 120.02 60.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.16 0.505 . . . . 0.0 111.324 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 10.6 m -76.27 134.38 39.8 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.77 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.527 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 20.8 m -141.14 157.78 22.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.874 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.527 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 4.5 tmtt? 85.99 62.6 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.21 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.461 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER -29.47 125.92 0.26 Allowed Pre-proline 0 C--N 1.334 -0.075 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.001 -179.492 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.485 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 8.1 Cg_exo -70.39 161.16 47.02 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.559 2.173 . . . . 0.0 113.023 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.46 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 1.6 p -135.78 165.49 25.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.92 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -90.97 19.86 5.32 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.361 0.6 . . . . 0.0 110.478 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 14.5 m -139.78 14.19 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.329 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.464 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 4.6 m-20 163.82 54.63 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.839 -179.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.485 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 5.2 Cg_exo -40.15 -25.56 0.17 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.509 2.806 . . . . 0.0 112.818 -179.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.566 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 52.5 p30 -30.99 148.41 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.328 0.585 . . . . 0.0 112.082 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -155.26 155.85 34.53 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.281 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.587 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -108.49 152.8 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.448 179.707 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.587 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.2 OUTLIER -123.48 142.69 39.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.736 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.496 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 1.8 mt-10 -108.29 128.4 54.71 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 179.161 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.545 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.8 OUTLIER -108.09 109.57 21.04 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.099 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.514 ' CB ' ' HA ' ' B' ' 411' ' ' VAL . 0.0 OUTLIER -145.59 -156.68 0.73 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.181 0.515 . . . . 0.0 111.704 -178.894 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.582 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -151.86 143.34 15.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.271 -179.443 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -38.23 -27.56 0.04 OUTLIER Glycine 0 C--N 1.332 0.353 0 CA-C-N 115.612 -0.722 . . . . 0.0 113.361 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . 0.42 ' OD1' ' C ' ' B' ' 408' ' ' ASP . 47.0 p30 -69.51 -4.71 20.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.812 0.339 . . . . 0.0 110.878 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 85.04 39.33 8.61 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.156 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.502 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 12.8 m -127.31 118.29 23.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.724 0.297 . . . . 0.0 111.659 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.514 ' HA ' ' CB ' ' B' ' 405' ' ' ARG . 52.1 t -92.96 112.1 25.67 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.807 179.364 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.545 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.5 OUTLIER -67.24 -37.64 83.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.383 179.418 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.46 ' O ' ' HB ' ' B' ' 414' ' ' THR . . . -174.35 -150.66 7.82 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.505 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.471 ' OG1' ' O ' ' B' ' 402' ' ' VAL . 13.2 t 176.09 155.3 0.21 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.694 0.283 . . . . 0.0 111.028 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.475 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -150.52 -177.18 24.2 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.461 -0.876 . . . . 0.0 112.796 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 2.2 p -153.16 161.55 2.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.796 0.331 . . . . 0.0 110.926 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.566 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -166.21 171.63 41.31 Favored Glycine 0 C--O 1.225 -0.454 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.933 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.531 ' N ' HD12 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -83.64 -39.92 19.64 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 117.067 0.434 . . . . 0.0 111.362 -179.857 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.631 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.2 OUTLIER -104.44 31.81 4.43 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.048 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.537 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.33 -45.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 178.875 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.631 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -45.9 -49.35 15.67 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.296 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.602 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -47.49 -40.62 7.08 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.62 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.935 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.537 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -65.77 -40.42 91.99 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.485 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.92 -67.91 1.89 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.552 -0.832 . . . . 0.0 111.227 178.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.515 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 1.1 mp -52.52 -47.27 48.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.602 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 11.4 tpt180 -51.37 -47.95 62.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.72 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.487 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -47.36 -49.52 24.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.46 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.517 ' HB2' ' CB ' ' B' ' 370' ' ' ALA . . . -56.34 -57.66 11.31 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.511 ' HA ' HD22 ' B' ' 432' ' ' LEU . 0.5 OUTLIER -49.36 -20.05 0.61 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.712 179.257 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.487 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 4.3 m-80 -83.86 -36.91 23.08 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.916 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.482 ' CB ' HD11 ' B' ' 374' ' ' LEU . . . -65.42 -40.69 93.65 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.857 0.36 . . . . 0.0 111.167 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.534 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.0 OUTLIER -89.57 9.41 26.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.98 179.89 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . 0.528 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 23.8 ttm180 -89.97 3.74 52.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.077 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.435 ' HB3' ' CB ' ' B' ' 437' ' ' MET . 48.3 m-20 -115.09 87.34 2.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.896 0.379 . . . . 0.0 111.116 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.531 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -50.19 -51.23 45.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.987 179.506 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.531 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -57.94 -43.84 86.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.602 179.61 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.523 ' CE ' ' HG ' ' B' ' 412' ' ' LEU . 9.2 tmm? -66.48 -49.67 65.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.134 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.522 ' CD2' HG13 ' B' ' 378' ' ' ILE . 47.4 mt -54.91 -63.31 1.19 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.042 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -56.22 -31.1 63.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.938 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.464 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.3 OUTLIER -59.22 -38.95 81.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.105 179.723 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.442 ' O ' ' HB2' ' B' ' 445' ' ' ARG . 43.3 m-85 -82.62 -21.09 35.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.782 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -67.47 -52.48 38.77 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -61.69 -45.0 95.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.502 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.63 -52.96 63.28 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.941 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.53 ' HD3' ' CD2' ' B' ' 380' ' ' TYR . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.269 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.718 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.549 ' O ' ' N ' ' B' ' 370' ' ' ALA . 7.3 t0 . . . . . 0 CA--C 1.521 -0.153 0 CA-C-O 120.713 0.292 . . . . 0.0 110.464 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.443 ' C ' ' O ' ' B' ' 367' ' ' ASP . 0.9 OUTLIER -33.49 -52.57 0.39 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.72 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.42 ' OD1' ' CE ' ' B' ' 368' ' ' MET . 66.2 m-20 -60.0 -42.73 94.88 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.401 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.549 ' N ' ' O ' ' B' ' 367' ' ' ASP . . . -61.35 -78.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.796 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -32.03 -44.75 0.09 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.834 -179.606 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.511 ' O ' ' HB2' ' B' ' 376' ' ' SER . 0.0 OUTLIER -58.62 -58.93 6.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.355 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.564 ' HG3' ' CB ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -47.28 -56.13 7.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.331 0.586 . . . . 0.0 110.974 179.814 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.478 ' CD2' ' N ' ' B' ' 374' ' ' LEU . 2.0 mt -46.39 -69.76 0.12 Allowed 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -178.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -89.77 -45.16 9.48 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -176.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.511 ' HB2' ' O ' ' B' ' 372' ' ' ARG . 49.6 m -67.48 -20.78 65.51 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.753 -179.071 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.543 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 2.1 tp -110.82 -39.25 4.89 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 120.639 0.257 . . . . 0.0 110.836 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.432 HD11 HG21 ' B' ' 378' ' ' ILE . 1.9 mm -126.91 -151.42 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.408 ' H ' ' CG2' ' B' ' 378' ' ' ILE . . . 40.81 64.85 1.14 Allowed Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.532 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.594 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 4.2 p90 -81.36 -61.74 1.86 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.558 0.179 . . . . 0.0 111.307 -179.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.53 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . 160.15 71.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 8.7 t 156.21 21.89 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.48 ' O ' ' HB3' ' B' ' 384' ' ' ARG . 0.8 OUTLIER -117.4 -26.39 6.7 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 122.063 -0.398 . . . . 0.0 110.949 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.48 ' HB3' ' O ' ' B' ' 383' ' ' LEU . 8.7 tpp180 79.59 48.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.552 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.579 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 5.2 tt -84.25 132.57 34.63 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 13.1 p-80 -164.94 147.8 8.36 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.527 ' CZ ' ' SG ' ' B' ' 404' ' ' CYS . 7.4 m-85 -103.26 144.92 30.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.133 178.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.432 HG23 ' HB2' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -123.97 125.17 70.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.167 0.508 . . . . 0.0 110.799 179.229 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.4 m -83.92 126.18 32.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.964 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.516 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 27.2 m -134.39 155.32 38.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.812 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.516 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 11.6 tptp 86.82 57.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.599 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER -33.87 122.02 0.49 Allowed Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.515 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.452 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 17.1 Cg_exo -63.14 162.33 26.76 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.608 2.205 . . . . 0.0 112.701 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.432 ' OG1' HG22 ' B' ' 396' ' ' VAL . 2.9 p -134.49 170.14 16.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.888 -179.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -93.47 16.93 12.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.833 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.432 HG22 ' OG1' ' B' ' 394' ' ' THR . 29.5 m -135.9 11.8 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.441 178.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.433 ' O ' ' N ' ' B' ' 399' ' ' ASN . 1.1 m-20 163.78 64.84 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.218 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.477 ' O ' ' C ' ' B' ' 399' ' ' ASN . 4.7 Cg_exo -37.05 -28.88 0.08 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 123.557 2.838 . . . . 0.0 112.363 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.486 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 8.3 m120 -21.91 121.88 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.483 -0.781 . . . . 0.0 112.347 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 400' ' ' SER . . . . . 0.444 ' O ' HG22 ' B' ' 416' ' ' VAL . 5.9 t -143.22 154.5 43.91 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.795 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.427 HG13 ' C ' ' B' ' 415' ' ' GLY . 16.8 tt -120.26 159.08 21.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.343 0.592 . . . . 0.0 111.381 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.485 ' CG2' ' C ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -121.08 152.61 24.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.276 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.432 ' HB2' HG23 ' B' ' 388' ' ' VAL . 32.3 mt-10 -122.12 125.31 45.9 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.981 0.42 . . . . 0.0 110.107 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.55 ' O ' ' N ' ' B' ' 412' ' ' LEU . 48.3 t -110.4 111.84 23.38 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.512 ' CB ' ' HA ' ' B' ' 411' ' ' VAL . 15.3 ptp180 -145.85 -175.86 4.91 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.232 0.539 . . . . 0.0 111.651 -179.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.579 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -146.68 144.96 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.134 -179.388 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . 0.481 ' O ' ' HB3' ' B' ' 408' ' ' ASP . . . 66.54 6.24 34.03 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.265 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . 0.481 ' HB3' ' O ' ' B' ' 407' ' ' GLY . 59.8 t0 74.85 39.66 0.4 Allowed 'General case' 0 C--O 1.23 0.078 0 CA-C-O 120.639 0.257 . . . . 0.0 111.536 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -167.12 -50.66 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.303 -0.951 . . . . 0.0 113.054 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.487 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 17.6 m -72.97 94.98 1.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.598 0.237 . . . . 0.0 111.2 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.512 ' HA ' ' CB ' ' B' ' 405' ' ' ARG . 95.4 t -82.82 111.46 19.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.786 0.327 . . . . 0.0 111.294 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.55 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.7 OUTLIER -65.44 -32.84 74.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.368 179.149 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 178.55 -158.25 22.63 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.608 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.444 HG23 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -156.19 167.67 29.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.791 0.329 . . . . 0.0 111.146 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.512 ' HA2' ' CG ' ' B' ' 426' ' ' ARG . . . -159.42 124.59 1.37 Allowed Glycine 0 C--O 1.225 -0.464 0 C-N-CA 120.531 -0.843 . . . . 0.0 112.572 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.444 ' HA ' ' HB3' ' B' ' 423' ' ' ALA . 10.1 p -124.33 151.88 29.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.778 0.323 . . . . 0.0 110.842 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.551 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -167.03 159.49 32.89 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.212 -0.994 . . . . 0.0 113.284 -179.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.535 ' N ' HD11 ' B' ' 422' ' ' ILE . 0.4 OUTLIER -67.18 -45.68 76.21 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.402 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.566 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.2 OUTLIER -98.68 30.17 3.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.215 0.531 . . . . 0.0 109.586 179.078 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.538 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 50.41 -44.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 115.227 1.566 . . . . 0.0 115.227 178.319 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.597 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -47.43 -48.93 26.24 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.595 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.597 ' N ' ' HD3' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -47.06 -37.23 3.84 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.628 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.169 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -69.02 -46.51 67.77 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.698 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.97 -59.34 10.95 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.429 -0.891 . . . . 0.0 111.424 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.51 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 1.2 mm -60.93 -40.15 84.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.804 0.335 . . . . 0.0 110.806 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.585 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 25.2 tpt180 -57.41 -42.09 81.6 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.376 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.476 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -62.12 -45.26 94.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.394 179.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.473 ' O ' HD21 ' B' ' 432' ' ' LEU . . . -56.16 -59.47 4.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.37 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.484 ' O ' ' HB2' ' B' ' 433' ' ' ARG . 1.0 OUTLIER -50.73 -31.46 16.71 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.127 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -63.86 -39.74 94.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.646 179.532 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.467 ' HB3' ' OH ' ' B' ' 387' ' ' TYR . . . -65.0 -41.62 95.21 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 120.993 0.425 . . . . 0.0 110.324 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.564 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -86.24 9.12 18.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.592 179.353 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . 0.484 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 2.3 ttm-85 -93.99 11.4 29.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.767 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.5 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 2.3 m-20 -125.39 79.81 1.84 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.805 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.505 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 10.4 ptpt -46.27 -48.9 17.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.016 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.505 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 3.3 mtpp -57.62 -46.62 83.9 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.817 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.5 ' HB3' ' HB2' ' B' ' 434' ' ' ASP . 1.5 tmm? -64.27 -65.12 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.049 0.452 . . . . 0.0 109.895 179.184 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.469 HD21 ' NE2' ' B' ' 373' ' ' GLN . 44.6 mt -39.13 -67.59 0.21 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.05 179.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -47.8 -43.95 28.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.69 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.467 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -52.64 -32.57 42.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.969 179.868 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' B' ' 438' ' ' LEU . 25.7 m-85 -75.57 -41.33 55.0 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.756 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' B' ' 445' ' ' ARG . . . -49.25 -43.9 43.26 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . 0.401 ' HD3' ' N ' ' B' ' 444' ' ' GLN . 0.1 OUTLIER -62.85 -50.45 70.86 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.769 178.512 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.401 ' N ' ' HD3' ' B' ' 443' ' ' LYS . 0.0 OUTLIER -55.52 -36.57 66.87 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.775 179.064 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.594 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 5.0 mmm-85 . . . . . 0 CA--C 1.519 -0.214 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.489 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.522 ' HB3' ' CD1' ' B' ' 425' ' ' ILE . 0.4 OUTLIER . . . . . 0 C--O 1.237 0.447 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.528 ' HE1' ' N ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -32.91 -56.09 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.112 178.93 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.528 ' N ' ' HE1' ' B' ' 368' ' ' MET . 2.7 m-20 -52.31 -56.1 17.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.376 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.566 ' CB ' ' CB ' ' B' ' 428' ' ' ALA . . . -43.4 -75.99 0.03 OUTLIER 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.442 ' HD3' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -35.78 -38.07 0.11 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.22 0.533 . . . . 0.0 110.36 179.849 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.545 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.1 tmt_? -59.6 -55.86 29.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.324 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.521 ' HG3' ' CB ' ' B' ' 432' ' ' LEU . 0.2 OUTLIER -50.4 -32.23 17.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.736 179.614 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.561 ' CD2' ' N ' ' B' ' 374' ' ' LEU . 0.1 OUTLIER -71.34 -78.41 0.08 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.714 -178.979 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -79.44 12.76 2.28 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -178.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -128.09 -28.46 2.62 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.705 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.464 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.4 OUTLIER -110.03 -16.9 13.71 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.758 -179.646 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.558 HG21 ' CD2' ' B' ' 441' ' ' TYR . 13.9 mm -132.35 -60.02 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 121.005 0.431 . . . . 0.0 110.041 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . . . . . . . . . . . -53.04 143.56 25.31 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.146 179.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.641 ' CE1' ' CZ ' ' B' ' 445' ' ' ARG . 0.5 OUTLIER -143.95 -48.94 0.29 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.557 -0.322 . . . . 0.0 111.537 179.82 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' B' ' 380' ' ' TYR . . . 171.76 -26.06 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.46 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.543 ' HB2' ' CE2' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -111.22 -6.51 14.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.808 0.337 . . . . 0.0 110.913 179.817 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.462 HD11 ' HB2' ' B' ' 385' ' ' LEU . 0.1 OUTLIER -48.18 -51.58 24.5 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.923 -179.968 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.448 ' HG2' ' HA3' ' B' ' 407' ' ' GLY . 2.3 tpt180 77.56 6.4 2.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.607 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.565 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 3.7 tt -49.54 135.28 18.51 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.793 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.417 ' CD2' ' O ' ' B' ' 386' ' ' HIS . 8.7 p-80 -153.35 134.46 14.06 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.365 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.574 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 6.9 m-85 -92.41 140.97 29.04 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.8 179.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -125.62 124.61 67.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.977 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 6.9 m -82.19 130.79 35.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.322 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.512 ' O ' HG22 ' B' ' 401' ' ' ILE . 21.6 m -135.25 160.07 40.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.279 0.562 . . . . 0.0 110.983 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.528 ' CB ' HG23 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 73.85 53.7 0.11 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.533 -179.623 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.476 ' C ' ' O ' ' B' ' 391' ' ' LYS . 3.7 mmtp -25.52 136.29 0.08 OUTLIER Pre-proline 0 N--CA 1.464 0.269 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.425 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -68.55 160.73 48.09 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.26 1.973 . . . . 0.0 112.59 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 1.5 p -127.59 158.79 36.55 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.835 -179.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -87.05 14.71 7.0 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.266 178.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 31.2 m -141.51 14.51 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.315 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 168.87 61.13 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 114.697 -1.138 . . . . 0.0 109.284 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.481 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 78.3 Cg_exo -41.8 -31.18 1.29 Allowed 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.329 2.686 . . . . 0.0 113.274 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.534 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.6 p-10 -28.39 119.32 0.12 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.803 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.51 150.41 52.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.578 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.595 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -107.22 150.38 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.303 -179.897 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.595 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.1 OUTLIER -121.75 153.28 25.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.341 -179.818 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.444 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 7.3 mt-10 -123.69 132.77 53.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.856 0.36 . . . . 0.0 110.174 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.574 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -115.84 115.2 25.84 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.44 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.506 ' HA ' ' O ' ' B' ' 410' ' ' THR . 2.1 ptm180 -143.73 -164.19 1.82 Allowed 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.173 0.511 . . . . 0.0 111.486 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.565 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -145.44 144.31 21.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.288 -179.401 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . 0.448 ' HA3' ' HG2' ' B' ' 384' ' ' ARG . . . -36.21 -29.96 0.02 OUTLIER Glycine 0 C--N 1.331 0.298 0 CA-C-N 115.744 -0.662 . . . . 0.0 113.309 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' B' ' 406' ' ' VAL . 2.8 t70 -66.08 -8.23 22.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.77 0.319 . . . . 0.0 110.899 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 86.68 39.88 7.45 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.462 -179.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.506 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 53.1 m -129.05 116.44 19.3 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.493 ' HA ' ' CB ' ' B' ' 405' ' ' ARG . 48.1 t -86.19 110.95 20.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.887 178.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.542 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.4 OUTLIER -64.49 -34.75 78.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.356 . . . . 0.0 110.304 179.742 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.435 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . -176.4 -154.9 12.24 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.677 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.467 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 12.9 t -173.78 168.99 4.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.693 0.283 . . . . 0.0 110.743 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.454 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -167.35 167.46 39.91 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.399 -0.905 . . . . 0.0 113.033 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.18 150.82 18.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 122.276 0.23 . . . . 0.0 110.388 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.537 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -160.26 143.5 9.1 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.927 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.489 ' N ' HD13 ' B' ' 422' ' ' ILE . 15.1 ptt180 -56.16 -47.04 79.01 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.623 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.5 OUTLIER -99.75 34.38 2.28 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 178.884 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.547 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.5 OUTLIER 46.35 -46.23 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 N-CA-C 115.506 1.669 . . . . 0.0 115.506 178.609 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.623 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -46.01 -48.17 16.7 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 -179.129 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.59 ' N ' ' CD ' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -48.52 -40.12 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.719 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.109 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.547 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -63.51 -44.28 94.77 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.363 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.07 -65.22 3.23 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.484 -0.865 . . . . 0.0 111.456 178.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.522 ' CD1' ' HB3' ' B' ' 367' ' ' ASP . 4.4 mm -52.94 -35.85 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.059 0.456 . . . . 0.0 110.382 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.581 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 3.6 tpt180 -63.45 -49.12 74.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.531 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.518 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -51.71 -41.73 61.7 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.287 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.566 ' CB ' ' CB ' ' B' ' 370' ' ' ALA . . . -58.76 -62.22 2.03 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.31 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.418 ' HA ' ' CG ' ' B' ' 432' ' ' LEU . 0.3 OUTLIER -53.78 -20.44 5.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.244 179.295 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.467 ' OD1' ' O ' ' B' ' 414' ' ' THR . 1.9 m-80 -76.1 -40.05 53.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.812 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.4 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -64.62 -39.08 93.07 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.253 0.549 . . . . 0.0 109.579 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.522 ' HA ' ' CD1' ' B' ' 438' ' ' LEU . 0.2 OUTLIER -85.19 8.09 19.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.538 179.008 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.85 -1.6 58.08 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.276 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.534 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 6.3 m-20 -111.44 83.56 1.79 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.918 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.479 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 1.6 ptmm? -50.75 -49.4 58.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.006 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.479 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 4.2 mmtp -61.36 -45.1 95.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.166 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.534 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 2.0 ttp -67.63 -51.45 49.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.939 0.4 . . . . 0.0 110.488 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.522 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 80.6 mt -51.13 -62.62 1.5 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.213 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -50.99 -38.72 52.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.317 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.58 ' CZ ' ' OE1' ' B' ' 444' ' ' GLN . 0.9 OUTLIER -55.23 -36.8 66.39 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.7 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.558 ' CD2' HG21 ' B' ' 378' ' ' ILE . 32.1 m-85 -73.36 -46.04 51.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.163 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . 0.416 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -41.88 -51.03 4.42 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -64.09 -42.18 97.03 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.58 ' OE1' ' CZ ' ' B' ' 440' ' ' PHE . 0.0 OUTLIER -53.59 -42.51 67.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.168 179.018 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.641 ' CZ ' ' CE1' ' B' ' 380' ' ' TYR . 40.2 mmt-85 . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.624 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.437 ' O ' ' HG2' ' B' ' 371' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.232 0 CA-C-O 120.964 0.412 . . . . 0.0 109.978 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.513 ' N ' ' HE3' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -36.09 -66.7 0.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.617 179.6 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -38.23 -48.87 1.33 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.5 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.496 ' CB ' ' HB2' ' B' ' 428' ' ' ALA . . . -60.38 -80.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.245 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.513 ' HE3' ' N ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -33.61 -40.44 0.07 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.99 0.424 . . . . 0.0 110.725 179.761 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.536 ' CZ ' ' HB3' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -57.13 -59.61 4.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.102 179.191 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.514 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -47.62 -49.46 27.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.171 0.51 . . . . 0.0 111.215 179.615 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.527 HD23 ' N ' ' B' ' 374' ' ' LEU . 0.9 OUTLIER -52.28 -70.51 0.09 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.263 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . 0.537 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.5 m-85 -80.72 -48.33 12.7 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -177.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.528 ' CB ' ' HD2' ' B' ' 372' ' ' ARG . 8.2 t -59.88 -26.45 65.88 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 -178.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 4.4 mm? -120.63 -25.24 5.56 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -178.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.519 HG13 ' CD2' ' B' ' 438' ' ' LEU . 3.1 mm -133.23 35.91 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.537 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -140.97 82.73 0.23 Allowed Glycine 0 C--N 1.33 0.215 0 C-N-CA 120.084 -1.055 . . . . 0.0 113.344 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.565 ' CD2' ' HD3' ' B' ' 445' ' ' ARG . 15.7 p90 -99.39 24.34 8.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.103 0.477 . . . . 0.0 109.872 178.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.487 ' HB1' ' O ' ' B' ' 380' ' ' TYR . . . 80.04 -89.46 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.497 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.442 ' C ' ' O ' ' B' ' 381' ' ' ALA . 55.6 m -33.2 -38.53 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.3 -179.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.498 ' HG ' ' CZ ' ' B' ' 380' ' ' TYR . 0.7 OUTLIER -41.49 -39.7 1.6 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.9 0.381 . . . . 0.0 110.968 -179.612 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.06 35.87 2.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.42 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.557 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 8.9 tt -75.03 123.86 25.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.547 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -147.9 147.35 29.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.539 0.685 . . . . 0.0 112.194 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.564 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 4.4 m-85 -92.47 155.43 17.85 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.935 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.36 125.19 53.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 4.3 m -88.72 131.53 34.99 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.597 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.494 ' O ' HG21 ' B' ' 401' ' ' ILE . 16.3 m -137.16 158.27 35.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.324 0.583 . . . . 0.0 111.454 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.548 ' HB2' ' CG2' ' B' ' 401' ' ' ILE . 0.1 OUTLIER 79.54 64.38 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.361 179.626 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.478 ' HA ' ' HD2' ' B' ' 393' ' ' PRO . 0.4 OUTLIER -39.46 103.79 0.3 Allowed Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.642 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.478 ' HD2' ' HA ' ' B' ' 392' ' ' LYS . 1.8 Cg_endo -45.99 165.52 0.07 OUTLIER 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.81 2.34 . . . . 0.0 112.961 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 3.1 p -124.38 162.27 24.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.671 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -85.4 12.44 8.32 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.509 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 20.3 m -141.5 10.0 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.249 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.533 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 0.2 OUTLIER -174.32 51.04 0.1 OUTLIER Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.465 -179.796 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.533 ' CD ' ' N ' ' B' ' 397' ' ' ASP . 95.4 Cg_exo -31.21 -29.52 0.02 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 124.164 3.242 . . . . 0.0 114.105 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.515 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.5 p-10 -37.06 129.38 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.822 0.344 . . . . 0.0 111.0 -179.311 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 28.4 t -143.94 158.56 43.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.237 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.548 ' CG2' ' HB2' ' B' ' 391' ' ' LYS . 0.5 OUTLIER -116.25 144.55 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-O 121.182 0.515 . . . . 0.0 111.771 -179.438 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.538 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.0 OUTLIER -127.11 128.67 70.71 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.603 179.951 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.503 ' CG ' ' OG1' ' B' ' 414' ' ' THR . 2.9 mt-10 -110.64 131.49 55.01 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.609 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.564 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 1.4 p -93.63 141.17 28.79 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.545 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.9 OUTLIER -162.16 -175.28 4.5 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.275 0.56 . . . . 0.0 112.345 -179.552 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.557 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -136.69 145.75 29.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.954 -179.622 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -34.89 -34.44 0.05 OUTLIER Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.654 -0.703 . . . . 0.0 113.742 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -60.82 -12.97 12.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.974 0.416 . . . . 0.0 110.726 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 91.03 36.3 6.75 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.722 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.545 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 18.5 m -118.65 116.46 26.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.538 0.209 . . . . 0.0 111.312 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.484 ' HA ' ' CB ' ' B' ' 405' ' ' ARG . 33.7 t -82.88 96.64 3.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.176 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.487 HD22 ' CA ' ' B' ' 405' ' ' ARG . 0.2 OUTLIER -50.89 -26.16 5.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.963 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.51 ' N ' ' SG ' ' B' ' 404' ' ' CYS . . . -177.44 -177.26 46.17 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 119.462 -1.351 . . . . 0.0 113.954 -179.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.503 ' OG1' ' CG ' ' B' ' 403' ' ' GLU . 6.3 m -148.56 120.08 7.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.28 -0.46 . . . . 0.0 110.469 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.514 ' O ' ' CD1' ' B' ' 401' ' ' ILE . . . -130.48 163.77 23.11 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.419 -0.895 . . . . 0.0 113.152 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.452 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 3.2 p -135.33 161.06 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.763 -0.218 . . . . 0.0 110.416 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.515 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -155.87 115.61 0.67 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.043 -1.075 . . . . 0.0 113.424 -179.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.518 ' N ' HD12 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -44.55 -54.82 5.67 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 122.189 0.196 . . . . 0.0 111.337 179.6 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.554 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.7 OUTLIER -86.98 -5.92 58.93 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.111 178.865 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.554 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 0.6 OUTLIER 94.46 -45.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 C-N-CA 123.65 0.78 . . . . 0.0 112.262 179.5 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -47.03 -60.56 2.37 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.616 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.616 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.0 OUTLIER -42.26 -32.69 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.509 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.973 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.531 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -68.09 -45.95 72.34 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.146 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.509 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.54 -58.19 12.16 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 119.81 -1.186 . . . . 0.0 111.519 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.469 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 1.9 mm -59.57 -36.28 64.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.768 0.318 . . . . 0.0 110.744 179.415 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.4 OUTLIER -62.15 -56.03 22.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.063 179.489 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.519 ' CB ' ' HB ' ' B' ' 402' ' ' VAL . . . -45.02 -42.3 8.24 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.017 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.496 ' HB2' ' CB ' ' B' ' 370' ' ' ALA . . . -53.62 -66.17 0.44 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.004 178.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.513 ' O ' ' N ' ' B' ' 433' ' ' ARG . 1.1 mt-10 -47.27 -44.37 22.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.687 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.448 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 0.7 OUTLIER -55.87 -29.49 60.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.909 179.685 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.449 ' O ' ' HE2' ' B' ' 437' ' ' MET . . . -72.3 -48.45 42.12 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 120.826 0.346 . . . . 0.0 110.421 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.558 ' CA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -97.05 13.36 29.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.818 179.437 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -87.07 7.24 28.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.982 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.545 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 2.0 m-20 -117.65 74.65 0.94 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.918 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.435 ' C ' ' O ' ' B' ' 434' ' ' ASP . 14.3 ptmt -36.84 -43.85 0.46 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.499 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.432 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.1 OUTLIER -64.36 -47.92 77.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.397 179.768 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.545 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 2.0 ttp -60.79 -51.46 69.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.416 179.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.558 HD11 ' CA ' ' B' ' 432' ' ' LEU . 60.0 mt -58.0 -57.78 11.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.592 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -53.02 -30.42 35.28 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.914 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.6 OUTLIER -66.38 -40.85 89.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.501 179.191 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.533 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 42.9 m-85 -75.12 -49.49 19.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.812 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -41.48 -46.32 3.44 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -38.88 81.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.355 178.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.533 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -60.08 -26.78 66.44 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.119 179.122 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.565 ' HD3' ' CD2' ' B' ' 380' ' ' TYR . 1.4 mmm180 . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.563 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.456 ' HB2' ' NZ ' ' B' ' 371' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.929 0.395 . . . . 0.0 110.667 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.495 ' HA ' ' CD ' ' B' ' 371' ' ' LYS . 4.2 tmm? -39.58 -46.36 1.76 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.666 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -56.45 -52.75 63.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.411 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.527 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -50.9 -69.78 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.022 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.495 ' CD ' ' HA ' ' B' ' 368' ' ' MET . 5.1 mttp -31.36 -53.71 0.23 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.124 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.535 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.7 ttt-85 -51.59 -45.92 63.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.553 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -57.14 -47.02 82.18 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.173 0.511 . . . . 0.0 110.737 179.491 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.427 ' O ' ' C ' ' B' ' 378' ' ' ILE . 3.6 mt -53.91 -68.57 0.17 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -179.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -85.73 -42.21 14.44 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -177.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.7 OUTLIER -67.84 -27.94 67.13 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.218 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -106.32 -31.34 8.66 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.773 0.32 . . . . 0.0 110.765 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.462 ' O ' ' C ' ' B' ' 379' ' ' GLY . 1.3 mm -137.24 -148.08 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.462 ' C ' ' O ' ' B' ' 378' ' ' ILE . . . 28.73 72.83 0.04 OUTLIER Glycine 0 C--N 1.332 0.359 0 C-N-CA 121.23 -0.509 . . . . 0.0 113.45 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.584 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 10.4 p90 -89.93 -55.41 3.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.662 0.268 . . . . 0.0 111.116 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -176.69 -48.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.817 0.342 . . . . 0.0 111.366 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.48 16.65 4.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.124 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.413 HD21 HG21 ' B' ' 378' ' ' ILE . 2.9 tp -103.21 -27.77 12.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.028 0.442 . . . . 0.0 110.807 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 8.0 tpp85 62.32 15.71 7.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.971 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.573 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 6.5 tt -48.02 128.74 14.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.702 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.552 ' CD2' ' O ' ' B' ' 386' ' ' HIS . 0.6 OUTLIER -158.59 136.95 10.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.304 0.573 . . . . 0.0 112.25 -179.639 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.584 ' CZ ' ' HB3' ' B' ' 404' ' ' CYS . 6.9 m-85 -87.86 162.93 16.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.578 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.555 HG22 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -138.35 147.58 25.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.97 178.498 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.12 109.94 19.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 0.0 110.668 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.518 ' O ' HG21 ' B' ' 401' ' ' ILE . 29.7 m -112.51 155.13 13.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.559 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.41 ' CB ' ' CG2' ' B' ' 401' ' ' ILE . 0.0 OUTLIER 67.68 69.38 0.35 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.413 -179.665 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.407 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 17.0 mmtt -54.56 149.27 21.88 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.097 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.525 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 11.2 Cg_exo -72.55 165.06 33.8 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 123.081 2.521 . . . . 0.0 112.526 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.465 HG21 ' O ' ' B' ' 393' ' ' PRO . 1.2 p -156.47 165.84 35.14 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.498 179.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -79.37 4.78 14.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.846 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.484 ' O ' ' HB3' ' B' ' 397' ' ' ASP . 6.1 m -130.99 17.06 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.292 0.568 . . . . 0.0 109.558 178.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.484 ' HB3' ' O ' ' B' ' 396' ' ' VAL . 2.8 p30 166.02 60.42 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.967 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.525 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 96.3 Cg_exo -39.4 -54.72 1.76 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.045 2.497 . . . . 0.0 112.934 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.478 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.8 OUTLIER -21.65 137.01 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.402 -178.558 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -143.69 141.53 30.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.973 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.531 ' CG1' ' O ' ' B' ' 415' ' ' GLY . 0.1 OUTLIER -111.16 139.0 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 CA-C-O 121.465 0.65 . . . . 0.0 111.776 -179.055 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.518 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.2 OUTLIER -102.27 176.65 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.055 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.555 ' CB ' HG22 ' B' ' 388' ' ' VAL . 4.9 mt-10 -156.2 106.98 2.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.984 0.421 . . . . 0.0 110.833 179.297 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.584 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -88.64 128.45 35.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.463 ' HA ' ' O ' ' B' ' 410' ' ' THR . 12.5 ptt180 -155.19 173.09 17.11 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.642 -179.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.573 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -132.81 132.59 59.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.87 -179.249 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' B' ' 406' ' ' VAL . . . -30.95 -32.14 0.01 OUTLIER Glycine 0 C--N 1.333 0.407 0 O-C-N 123.436 0.46 . . . . 0.0 113.555 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . 0.545 ' N ' ' O ' ' B' ' 406' ' ' VAL . 21.4 t0 -57.17 -16.42 7.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.014 0.435 . . . . 0.0 110.387 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 95.72 35.86 5.49 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.785 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.469 ' HB ' HG21 ' B' ' 406' ' ' VAL . 16.9 m -128.28 124.79 37.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.082 0.468 . . . . 0.0 111.737 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.471 HG11 ' O ' ' B' ' 413' ' ' GLY . 47.9 t -89.2 89.43 3.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.525 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.526 HD11 ' CE ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -46.01 -26.44 0.73 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.897 0.38 . . . . 0.0 110.23 -179.928 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.471 ' O ' HG11 ' B' ' 411' ' ' VAL . . . 177.61 -173.77 46.37 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.858 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.467 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 3.4 t -160.64 171.37 19.03 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.531 ' O ' ' CG1' ' B' ' 401' ' ' ILE . . . -173.01 170.41 43.56 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 118.525 -1.798 . . . . 0.0 114.836 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.511 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 5.2 p -136.76 152.05 28.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.321 -0.439 . . . . 0.0 110.209 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.479 ' HA3' HD11 ' B' ' 422' ' ' ILE . . . -153.66 111.54 0.49 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.904 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.518 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -42.05 -56.77 2.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.739 0.304 . . . . 0.0 110.923 179.706 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.603 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.1 OUTLIER -82.7 -11.27 58.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.248 179.151 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.603 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 97.12 -44.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.249 0 C-N-CA 123.873 0.869 . . . . 0.0 111.903 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.506 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.5 OUTLIER -48.08 -59.31 3.48 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.534 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.561 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -41.86 -31.42 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 177.845 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.523 ' CB ' ' O ' ' B' ' 420' ' ' ILE . . . -71.65 -45.33 62.34 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.687 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.11 -59.9 9.27 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 119.906 -1.14 . . . . 0.0 111.702 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.489 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 1.2 mm -57.84 -51.23 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.89 0.376 . . . . 0.0 110.797 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.561 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -46.37 -51.17 15.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.237 179.687 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -51.1 -54.15 27.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.807 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.519 ' HB2' ' CB ' ' B' ' 370' ' ' ALA . . . -51.94 -65.5 0.55 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.253 0.549 . . . . 0.0 110.639 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.495 ' O ' ' HB2' ' B' ' 433' ' ' ARG . 55.9 mt-10 -52.87 -19.52 2.61 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.443 179.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.481 ' ND2' ' HG3' ' B' ' 426' ' ' ARG . 0.8 OUTLIER -77.97 -32.47 51.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.34 -179.795 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.3 -42.53 44.96 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.345 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.531 ' HA ' ' CD1' ' B' ' 438' ' ' LEU . 0.0 OUTLIER -87.33 14.48 7.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.759 179.807 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . 0.495 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 8.2 ttt85 -88.01 4.65 44.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.67 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.518 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 12.7 m-20 -116.07 72.37 0.81 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.074 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.505 ' HG3' ' N ' ' B' ' 436' ' ' LYS . 15.2 ptpt -41.69 -47.33 3.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.686 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.505 ' N ' ' HG3' ' B' ' 435' ' ' LYS . 1.7 mmmm -58.4 -47.63 83.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.146 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.526 ' CE ' HD11 ' B' ' 412' ' ' LEU . 13.2 tmm? -65.79 -54.7 23.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.012 0.434 . . . . 0.0 109.864 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.531 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 99.2 mt -51.61 -68.07 0.2 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.221 179.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -44.41 -36.2 2.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.859 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.633 ' CE2' ' CE1' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -60.98 -41.91 97.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.26 0.552 . . . . 0.0 109.639 179.692 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.633 ' CE1' ' CE2' ' B' ' 440' ' ' PHE . 40.9 m-85 -75.54 -33.7 60.7 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.545 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.81 -46.1 64.14 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.93 -45.62 77.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.479 178.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.545 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -57.99 -25.92 61.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.306 179.376 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.584 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.434 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.472 ' N ' ' OD1' ' B' ' 367' ' ' ASP . 0.5 OUTLIER . . . . . 0 C--O 1.233 0.226 0 CA-C-O 120.774 0.321 . . . . 0.0 110.4 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.603 ' CE ' ' ND2' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -37.49 -44.75 0.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.54 -179.846 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.603 ' ND2' ' CE ' ' B' ' 368' ' ' MET . 5.2 m-20 -52.1 -57.97 7.96 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.057 0.456 . . . . 0.0 110.337 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.519 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -57.66 -72.51 0.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.622 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.545 ' CG ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -36.04 -31.92 0.03 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.977 0.418 . . . . 0.0 110.21 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.581 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.1 OUTLIER -65.42 -54.02 34.7 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.56 178.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.543 ' HG3' ' CB ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -53.73 -37.89 63.8 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.367 0.603 . . . . 0.0 110.328 179.017 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' B' ' 379' ' ' GLY . 2.9 mt -64.56 -79.37 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -178.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -85.47 12.42 8.49 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.581 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -127.2 -15.38 5.24 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.686 -0.406 . . . . 0.0 111.741 179.805 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.525 ' O ' ' CD1' ' B' ' 378' ' ' ILE . 9.0 mp -124.98 -21.77 4.62 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.808 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.632 ' CG2' ' CG ' ' B' ' 441' ' ' TYR . 12.1 mm -137.41 -72.39 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.54 ' N ' ' O ' ' B' ' 374' ' ' LEU . . . -47.14 79.45 0.0 OUTLIER Glycine 0 CA--C 1.52 0.37 0 CA-C-N 116.201 -0.454 . . . . 0.0 113.807 -179.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.553 ' N ' ' O ' ' B' ' 378' ' ' ILE . 45.3 p90 -76.9 -161.07 0.18 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.649 0.261 . . . . 0.0 111.058 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.553 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -84.7 105.73 15.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.693 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.553 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.1 t 91.22 47.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.719 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.455 HD12 ' HA2' ' B' ' 379' ' ' GLY . 4.5 tt -101.93 -23.21 14.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.889 0.376 . . . . 0.0 110.276 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.493 ' O ' ' ND1' ' B' ' 386' ' ' HIS . 13.7 tpt180 81.28 5.0 1.4 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.354 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.587 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 6.1 tt -57.13 135.23 56.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.945 0.403 . . . . 0.0 110.376 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.493 ' ND1' ' O ' ' B' ' 384' ' ' ARG . 18.3 p-80 -167.05 147.41 5.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.405 0.621 . . . . 0.0 112.375 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.524 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 4.1 m-85 -98.85 138.66 35.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.385 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.41 HG21 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -118.01 118.77 59.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.298 0.57 . . . . 0.0 110.629 179.272 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 53.9 m -78.64 129.19 34.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.982 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.523 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 27.3 m -136.71 154.29 31.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.666 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 84.88 49.27 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.354 -179.539 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.444 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER -29.76 109.44 0.25 Allowed Pre-proline 0 N--CA 1.462 0.144 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.33 -179.433 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.471 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 1.9 Cg_endo -48.01 158.54 0.84 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 122.816 2.344 . . . . 0.0 113.422 -179.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.429 ' OG1' ' CG ' ' B' ' 397' ' ' ASP . 40.2 p -124.69 165.01 18.69 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.729 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -88.63 15.8 7.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.802 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.574 ' O ' ' CG2' ' B' ' 396' ' ' VAL . 0.2 OUTLIER -141.6 9.56 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.937 0.875 . . . . 0.0 109.909 179.51 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.429 ' CG ' ' OG1' ' B' ' 394' ' ' THR . 3.5 p-10 171.22 59.12 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.543 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.481 ' O ' ' C ' ' B' ' 399' ' ' ASN . 5.2 Cg_exo -39.34 -31.55 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 123.611 2.874 . . . . 0.0 112.412 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.491 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 13.9 m120 -25.38 109.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.568 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 400' ' ' SER . . . . . 0.406 ' O ' ' HA ' ' B' ' 416' ' ' VAL . 12.9 m -127.92 162.53 26.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.605 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.55 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.6 OUTLIER -119.78 151.01 22.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.517 -179.882 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.55 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.1 OUTLIER -120.27 154.3 23.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.453 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 13.6 mm-40 -122.81 130.15 52.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.809 0.338 . . . . 0.0 110.685 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.532 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.5 OUTLIER -112.43 112.67 24.39 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.842 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.52 ' CG ' ' N ' ' B' ' 406' ' ' VAL . 0.1 OUTLIER -138.64 -166.33 1.99 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 121.349 0.595 . . . . 0.0 111.888 -178.823 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.587 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -157.79 140.4 6.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.328 -179.354 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . 0.44 ' HA2' ' HG2' ' B' ' 384' ' ' ARG . . . 64.78 6.73 25.24 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.551 -0.833 . . . . 0.0 111.322 -178.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 20.6 t70 72.41 35.45 1.17 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.685 0.279 . . . . 0.0 111.11 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -155.73 -49.46 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.497 -0.858 . . . . 0.0 113.22 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.488 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 53.4 m -82.12 105.65 13.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.681 0.277 . . . . 0.0 111.68 -179.4 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.408 ' CG1' ' OE1' ' B' ' 403' ' ' GLU . 79.1 t -90.06 111.07 22.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.651 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.4 OUTLIER -64.65 -35.23 80.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.313 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.461 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 175.76 -148.68 9.5 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.561 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.501 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 8.7 t -168.53 166.84 11.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.776 0.322 . . . . 0.0 111.301 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.429 ' HA3' ' CG ' ' B' ' 426' ' ' ARG . . . -154.8 136.87 5.38 Favored Glycine 0 C--O 1.228 -0.259 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.679 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.416 HG21 ' N ' ' B' ' 417' ' ' GLY . 8.4 p -122.69 149.19 26.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.555 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -163.63 151.88 21.57 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.135 -1.031 . . . . 0.0 113.24 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.517 ' N ' HD12 ' B' ' 422' ' ' ILE . 0.6 OUTLIER -62.83 -45.45 92.56 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.359 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.623 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.5 OUTLIER -100.02 32.19 3.03 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.892 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.543 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 47.42 -44.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 178.499 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.623 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -47.88 -45.46 30.45 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 119.12 0.873 . . . . 0.0 108.93 -179.219 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.591 ' N ' ' CD ' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -49.95 -40.55 16.68 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.785 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 177.873 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.543 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -62.2 -46.04 90.66 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.492 178.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.49 -70.03 1.13 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.404 -0.903 . . . . 0.0 111.604 178.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.471 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 0.5 OUTLIER -50.92 -33.47 12.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.315 179.284 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.586 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 1.5 tpt180 -63.76 -57.89 8.56 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.513 179.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.515 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . . . -42.97 -39.59 2.66 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.506 ' CB ' ' HB3' ' B' ' 370' ' ' ALA . . . -60.29 -60.46 3.78 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.515 ' O ' HD22 ' B' ' 432' ' ' LEU . 32.2 mt-10 -47.66 -21.28 0.35 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.281 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.501 ' ND2' ' O ' ' B' ' 414' ' ' THR . 1.7 m-80 -81.57 -36.48 29.01 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.741 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.434 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -63.62 -38.38 90.91 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.161 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.543 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.0 OUTLIER -94.08 11.68 29.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.991 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . 0.463 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 0.9 OUTLIER -92.8 4.62 53.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.142 -179.79 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.499 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 15.6 m-20 -119.31 92.14 3.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 0.0 110.85 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.438 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -56.38 -46.43 80.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.476 -179.635 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.438 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -60.61 -42.14 96.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.943 0.401 . . . . 0.0 110.548 -179.8 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.514 ' SD ' ' CD1' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -71.37 -46.49 60.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.164 179.442 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.458 HD23 ' HA ' ' B' ' 432' ' ' LEU . 54.5 mt -56.12 -65.41 0.61 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.115 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -51.16 -36.48 41.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.97 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.464 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.9 OUTLIER -53.55 -44.42 69.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.67 179.642 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.632 ' CG ' ' CG2' ' B' ' 378' ' ' ILE . 43.0 m-85 -65.16 -49.47 69.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.539 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . 0.412 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -39.24 -51.19 1.99 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -38.81 92.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.979 178.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.517 ' N ' ' O ' ' B' ' 441' ' ' TYR . 3.5 mt-30 -64.6 -36.76 85.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.044 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.497 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.159 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.57 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.519 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.461 ' O ' ' HB2' ' B' ' 372' ' ' ARG . 1.7 ttp -36.17 -43.0 0.33 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.509 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -64.27 -43.27 95.34 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.85 0.357 . . . . 0.0 110.681 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.539 ' CB ' ' HB1' ' B' ' 428' ' ' ALA . . . -65.75 -74.87 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.438 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.463 ' HD2' ' HB2' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -33.92 -46.18 0.22 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.104 0.478 . . . . 0.0 110.571 179.826 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.466 ' O ' ' HB3' ' B' ' 376' ' ' SER . 9.5 ttp85 -60.44 -45.85 92.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.004 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.2 OUTLIER -60.17 -53.15 61.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.0 -179.244 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.492 HD13 ' HA ' ' B' ' 428' ' ' ALA . 0.3 OUTLIER -56.74 -64.13 0.97 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -178.448 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . 0.504 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.3 m-85 -78.26 -52.09 9.17 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -177.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.466 ' HB3' ' O ' ' B' ' 372' ' ' ARG . 1.3 t -69.05 -29.15 67.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.49 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.9 OUTLIER -102.89 -35.53 8.56 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.665 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.454 HG13 HD21 ' B' ' 438' ' ' LEU . 8.1 mm -136.01 37.44 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.504 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -121.61 81.13 0.34 Allowed Glycine 0 CA--C 1.517 0.207 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.8 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.631 ' CE2' ' CD1' ' B' ' 383' ' ' LEU . 36.1 p90 -105.11 174.37 5.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.887 0.375 . . . . 0.0 110.812 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -80.07 82.17 6.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.15 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.508 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 0.6 OUTLIER 160.71 -31.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.162 179.792 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.631 ' CD1' ' CE2' ' B' ' 380' ' ' TYR . 0.2 OUTLIER -54.21 -54.97 32.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.925 0.393 . . . . 0.0 110.468 179.784 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' B' ' 385' ' ' LEU . 5.4 tpt180 76.28 46.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.414 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.499 ' HA ' HG12 ' B' ' 406' ' ' VAL . 3.0 mt -38.82 140.22 0.38 Allowed 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -140.8 89.27 2.25 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -177.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.565 ' CZ ' ' SG ' ' B' ' 404' ' ' CYS . 39.7 m-85 -91.87 122.76 34.7 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 177.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -114.83 118.16 57.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.396 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 8.4 m -83.81 110.16 18.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.657 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.54 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 35.9 m -115.92 149.93 18.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.16 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.54 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 88.68 58.54 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.077 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.438 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER -38.13 142.89 0.44 Allowed Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.507 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' B' ' 392' ' ' LYS . 7.0 Cg_exo -71.37 158.76 53.5 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.181 1.921 . . . . 0.0 113.019 -178.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 34.8 p -129.62 161.02 31.51 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.355 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -85.32 14.26 5.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.563 179.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' B' ' 397' ' ' ASP . 4.7 m -136.89 9.26 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.886 178.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' B' ' 396' ' ' VAL . 0.2 OUTLIER 168.7 62.94 0.01 OUTLIER Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.785 -179.483 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.449 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 1.6 Cg_endo -42.08 -35.71 3.44 Favored 'Trans proline' 0 N--CA 1.464 -0.225 0 C-N-CA 123.687 2.925 . . . . 0.0 112.572 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.523 ' ND2' ' O ' ' B' ' 399' ' ' ASN . 1.2 p-10 -29.01 121.12 0.13 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.041 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 400' ' ' SER . . . . . 0.401 ' O ' HG23 ' B' ' 416' ' ' VAL . 1.3 t -131.42 162.5 30.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.053 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.491 HD11 ' OG1' ' B' ' 414' ' ' THR . 0.0 OUTLIER -120.42 155.87 23.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.963 0.411 . . . . 0.0 111.501 -179.423 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.484 ' O ' HD11 ' B' ' 401' ' ' ILE . 0.1 OUTLIER -126.45 139.73 50.84 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.831 -179.591 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -102.26 119.86 39.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.939 0.399 . . . . 0.0 110.476 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.565 ' SG ' ' CZ ' ' B' ' 387' ' ' TYR . 5.6 t -92.22 95.35 9.67 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.489 ' HA ' ' O ' ' B' ' 410' ' ' THR . 35.3 ttp180 -129.16 162.27 28.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.461 -178.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.499 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -139.64 144.56 28.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.074 -179.657 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 55.97 14.0 7.36 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.298 -0.953 . . . . 0.0 111.296 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 13.1 t70 57.51 23.01 8.67 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 120.801 0.334 . . . . 0.0 110.288 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -139.96 -0.71 1.92 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.238 -0.982 . . . . 0.0 113.703 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.489 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 23.3 m -142.83 117.59 9.87 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 117.237 0.518 . . . . 0.0 111.759 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.475 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 73.4 t -95.55 108.51 21.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.589 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.556 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.4 OUTLIER -63.06 -37.2 86.24 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.85 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 175.21 -139.93 5.01 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.213 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.491 ' OG1' HD11 ' B' ' 401' ' ' ILE . 3.0 t -170.12 168.48 8.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.684 0.278 . . . . 0.0 110.854 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.465 ' HA3' ' CG ' ' B' ' 426' ' ' ARG . . . -159.99 131.84 2.8 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.497 -0.858 . . . . 0.0 112.424 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.452 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 7.7 p -119.15 146.05 24.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.528 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -154.53 144.37 11.08 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.057 -1.068 . . . . 0.0 112.992 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.476 ' N ' HD12 ' B' ' 422' ' ' ILE . 5.5 ptm180 -57.01 -45.87 82.73 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.846 0.355 . . . . 0.0 111.69 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.629 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.0 OUTLIER -99.34 29.41 3.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.274 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.567 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.5 OUTLIER 50.74 -45.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 179.133 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.629 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -45.24 -56.73 4.55 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 118.884 0.765 . . . . 0.0 109.247 179.884 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.576 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -42.01 -33.77 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 177.882 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.567 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -67.82 -48.62 65.72 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.047 -0.979 . . . . 0.0 109.781 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -60.9 -58.8 11.9 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 119.866 -1.159 . . . . 0.0 111.345 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . . . . . . . . . 3.4 mp -56.27 -39.55 60.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.503 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.576 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.8 tpt180 -61.84 -52.31 64.69 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.342 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.485 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -45.6 -42.01 10.7 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.539 ' HB1' ' CB ' ' B' ' 370' ' ' ALA . . . -60.28 -58.18 9.62 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.521 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.581 ' O ' ' CD2' ' B' ' 432' ' ' LEU . 2.9 tm-20 -52.92 -17.18 1.28 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.552 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.485 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 1.4 m-80 -81.02 -38.92 26.66 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.096 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.471 ' O ' ' HE3' ' B' ' 437' ' ' MET . . . -62.61 -45.26 93.68 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.916 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.581 ' CD2' ' O ' ' B' ' 429' ' ' GLU . 0.1 OUTLIER -83.29 1.86 38.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.756 179.455 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 0.2 OUTLIER -78.83 6.94 7.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.213 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.55 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 84.4 m-20 -130.12 83.76 2.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.89 0.376 . . . . 0.0 111.379 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.579 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.2 OUTLIER -48.27 -53.97 15.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.514 179.682 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.579 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 3.5 mmpt? -54.4 -42.21 70.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.555 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.55 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 0.3 OUTLIER -70.59 -34.55 72.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.805 179.21 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.46 HD13 ' HA ' ' B' ' 432' ' ' LEU . 7.2 mt -65.62 -63.96 0.97 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -54.79 -26.9 37.67 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.474 ' HB3' ' O ' ' B' ' 437' ' ' MET . 2.7 t80 -61.55 -44.0 97.83 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.499 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.4 ' CE2' ' HG2' ' B' ' 437' ' ' MET . 49.7 m-85 -69.86 -26.67 64.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.18 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -59.69 -48.77 80.34 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -63.36 -41.93 98.87 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.768 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.48 -34.5 76.96 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.115 0.483 . . . . 0.0 109.808 178.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.613 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.005 179.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.47 0.561 0 CA-C-O 120.814 0.34 . . . . 0.0 111.703 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.472 ' O ' ' HG3' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -44.36 -62.36 1.2 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.017 179.23 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.23 -32.95 50.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.37 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.487 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -58.0 -81.56 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.463 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -37.33 -44.82 0.63 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.129 0.49 . . . . 0.0 110.175 179.519 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.543 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.7 OUTLIER -57.26 -47.32 81.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.47 179.343 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.487 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -57.71 -44.15 85.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.147 0.498 . . . . 0.0 111.159 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.523 ' CD2' HD12 ' B' ' 432' ' ' LEU . 0.6 OUTLIER -59.16 -70.13 0.17 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -178.393 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . 0.456 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.0 m-85 -83.36 -32.34 26.28 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -177.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -81.56 -24.79 36.32 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -178.913 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.476 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 2.4 mm? -117.3 -18.96 9.78 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.469 ' O ' HD12 ' B' ' 385' ' ' LEU . 1.6 mm -144.12 44.99 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.832 0.349 . . . . 0.0 111.342 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.456 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -165.43 60.56 0.24 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.692 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.574 ' CD1' ' HD3' ' B' ' 445' ' ' ARG . 22.3 p90 -63.45 -56.98 11.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.776 0.322 . . . . 0.0 110.512 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.432 ' HB1' ' O ' ' B' ' 380' ' ' TYR . . . 166.7 31.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.986 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.403 ' CB ' ' CE2' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -169.81 28.85 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.856 0.36 . . . . 0.0 110.981 179.806 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.574 ' O ' ' N ' ' B' ' 385' ' ' LEU . 0.2 OUTLIER -108.12 20.34 18.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.459 179.803 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.458 ' HB3' ' HA3' ' B' ' 407' ' ' GLY . 0.6 OUTLIER 26.49 37.58 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 O-C-N 123.786 0.679 . . . . 0.0 111.689 179.597 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.574 ' N ' ' O ' ' B' ' 383' ' ' LEU . 0.5 OUTLIER -67.17 130.86 44.45 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.948 0.404 . . . . 0.0 110.544 -179.805 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.577 ' CD2' ' O ' ' B' ' 386' ' ' HIS . 5.4 p-80 -167.7 133.23 1.97 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.316 0.579 . . . . 0.0 112.194 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.572 ' CE2' ' SG ' ' B' ' 404' ' ' CYS . 34.4 m-85 -85.71 -177.25 6.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.033 178.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.503 HG22 ' O ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -160.42 111.51 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.3 0.572 . . . . 0.0 111.358 178.286 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.9 m -74.61 116.13 14.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.954 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.496 ' O ' HG23 ' B' ' 401' ' ' ILE . 23.9 m -126.1 151.16 32.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.582 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.468 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 79.42 49.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.474 -179.673 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.442 ' C ' ' O ' ' B' ' 391' ' ' LYS . 36.1 mttt -32.3 127.33 0.35 Allowed Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.11 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.497 ' C ' ' CG2' ' B' ' 394' ' ' THR . 12.3 Cg_endo -56.8 -170.77 0.03 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.723 2.282 . . . . 0.0 112.064 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.497 ' CG2' ' C ' ' B' ' 393' ' ' PRO . 0.1 OUTLIER -168.33 168.3 11.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.001 -179.906 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -71.6 -10.22 59.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.923 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.485 HG22 ' OG1' ' B' ' 394' ' ' THR . 33.5 m -128.28 12.87 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 CA-C-O 121.378 0.609 . . . . 0.0 110.104 178.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.558 ' N ' ' HD3' ' B' ' 398' ' ' PRO . 0.2 OUTLIER -164.24 56.68 0.52 Allowed Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.913 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.558 ' HD3' ' N ' ' B' ' 397' ' ' ASP . 50.2 Cg_exo -53.75 -19.19 14.01 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.093 2.529 . . . . 0.0 113.166 -179.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.559 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 43.9 p-10 -65.09 139.57 58.73 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 121.301 0.572 . . . . 0.0 111.474 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 400' ' ' SER . . . . . 0.548 ' O ' ' HA ' ' B' ' 416' ' ' VAL . 17.6 t -137.41 161.08 37.28 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.771 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.496 HG23 ' O ' ' B' ' 390' ' ' VAL . 4.8 tp -128.79 113.04 27.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 121.18 0.514 . . . . 0.0 111.243 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.471 ' O ' HG23 ' B' ' 414' ' ' THR . 1.9 t -79.3 164.31 3.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.846 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.503 ' O ' HG22 ' B' ' 388' ' ' VAL . 1.3 mm-40 -133.23 106.36 7.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.174 0.511 . . . . 0.0 110.812 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.572 ' SG ' ' CE2' ' B' ' 387' ' ' TYR . 2.0 t -85.9 108.59 18.23 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.476 ' O ' ' O ' ' B' ' 386' ' ' HIS . 0.0 OUTLIER -140.26 151.7 45.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.072 0.463 . . . . 0.0 111.375 -179.379 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.573 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -123.35 126.78 73.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.512 -179.248 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . 0.458 ' HA3' ' HB3' ' B' ' 384' ' ' ARG . . . -28.52 -35.67 0.01 OUTLIER Glycine 0 C--N 1.331 0.277 0 CA-C-N 115.652 -0.704 . . . . 0.0 113.758 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' B' ' 406' ' ' VAL . 58.9 t0 -53.36 -20.98 5.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.231 0.539 . . . . 0.0 110.151 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 101.8 42.88 2.2 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.081 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.458 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 13.9 m -137.79 133.24 33.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.921 0.391 . . . . 0.0 111.774 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.488 ' HA ' ' O ' ' B' ' 404' ' ' CYS . 42.9 t -94.63 88.13 2.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.61 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.483 ' CB ' ' HE1' ' B' ' 437' ' ' MET . 0.1 OUTLIER -51.47 -13.63 0.24 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.316 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.413 ' N ' ' HB3' ' B' ' 404' ' ' CYS . . . 153.51 -165.65 31.5 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 119.62 -1.276 . . . . 0.0 113.39 178.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.471 HG23 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -142.27 173.77 11.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.75 0.31 . . . . 0.0 110.563 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.526 ' HA2' ' CG ' ' B' ' 426' ' ' ARG . . . -146.61 98.9 0.2 Allowed Glycine 0 C--O 1.225 -0.416 0 C-N-CA 120.324 -0.941 . . . . 0.0 112.626 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.548 ' HA ' ' O ' ' B' ' 400' ' ' SER . 13.5 p -105.45 157.46 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.893 0.347 . . . . 0.0 110.193 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.559 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . 166.63 138.13 2.37 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 119.422 -1.37 . . . . 0.0 113.496 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.508 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.1 OUTLIER -47.09 -67.41 0.28 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.005 0.431 . . . . 0.0 109.957 179.403 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.784 ' O ' ' N ' ' B' ' 421' ' ' LYS . 2.1 p-10 -85.01 91.81 8.18 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 176.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.532 ' O ' ' CB ' ' B' ' 423' ' ' ALA . 0.9 OUTLIER -17.74 -31.5 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -177.411 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.784 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.6 OUTLIER -44.83 -57.05 3.99 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.831 179.011 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.578 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.2 OUTLIER -44.98 -39.44 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.569 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.579 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.532 ' CB ' ' O ' ' B' ' 420' ' ' ILE . . . -63.35 -37.6 87.9 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.827 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -70.31 -65.48 2.51 Favored Glycine 0 C--N 1.334 0.45 0 C-N-CA 120.206 -0.997 . . . . 0.0 111.724 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . . . . . . . . . 3.1 mp -53.76 -35.39 26.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.228 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.578 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 1.7 tpt180 -61.59 -53.27 58.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.002 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.53 ' HB2' ' CE2' ' B' ' 387' ' ' TYR . . . -45.51 -45.88 13.57 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.916 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.499 ' O ' ' N ' ' B' ' 431' ' ' ALA . . . -56.54 -72.39 0.08 Allowed 'General case' 0 C--O 1.238 0.467 0 CA-C-O 121.147 0.499 . . . . 0.0 110.216 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.514 ' O ' HD22 ' B' ' 432' ' ' LEU . 19.9 mt-10 -45.61 -25.77 0.51 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.026 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.489 ' ND2' ' HD2' ' B' ' 426' ' ' ARG . 1.3 m-80 -72.33 -34.22 67.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.218 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.499 ' N ' ' O ' ' B' ' 428' ' ' ALA . . . -65.83 -43.96 86.98 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.451 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.523 HD12 ' CD2' ' B' ' 374' ' ' LEU . 0.0 OUTLIER -101.42 25.93 7.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.021 0.439 . . . . 0.0 110.645 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 20.3 ttt180 -94.4 -9.84 34.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.07 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.408 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 3.6 m-20 -109.29 95.13 5.42 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.786 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.538 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 2.5 ptmt -56.33 -31.64 63.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.5 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.538 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 5.9 mtpt -66.15 -54.86 20.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.525 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.487 ' CE ' ' O ' ' B' ' 431' ' ' ALA . 17.5 tmm? -63.86 -46.94 82.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.299 179.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.522 ' CD2' ' HA ' ' B' ' 432' ' ' LEU . 71.4 mt -55.24 -59.05 5.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.961 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -64.49 -24.68 67.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.678 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.602 ' CE2' ' CZ ' ' B' ' 441' ' ' TYR . 0.1 OUTLIER -62.28 -47.29 84.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.134 0.493 . . . . 0.0 109.783 179.561 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.602 ' CZ ' ' CE2' ' B' ' 440' ' ' PHE . 64.9 m-85 -76.94 -41.51 42.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.153 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -44.01 -45.19 7.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.97 -45.67 66.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.288 178.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.516 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -52.32 -24.52 7.66 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.652 178.86 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.574 ' HD3' ' CD1' ' B' ' 380' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.04 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.172 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.468 ' HA ' ' NZ ' ' B' ' 371' ' ' LYS . 2.1 ttp -36.2 -52.67 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.355 179.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.46 -42.0 98.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.161 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.527 ' HB3' ' CB ' ' B' ' 428' ' ' ALA . . . -65.41 -83.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.943 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.485 ' C ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -26.67 -49.91 0.04 OUTLIER 'General case' 0 C--O 1.235 0.301 0 O-C-N 123.428 0.455 . . . . 0.0 111.053 179.769 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.492 ' O ' ' HB2' ' B' ' 376' ' ' SER . 35.7 ttp85 -54.08 -61.97 1.96 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.359 179.168 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.54 ' HA ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -47.61 -54.53 11.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 111.09 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.448 HD11 ' OH ' ' B' ' 387' ' ' TYR . 7.7 mt -42.86 -67.85 0.24 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -178.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . 0.523 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-30 -93.16 -48.3 6.53 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.601 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.492 ' HB2' ' O ' ' B' ' 372' ' ' ARG . 11.9 m -60.61 -13.94 17.37 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 121.259 -0.176 . . . . 0.0 111.338 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.54 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.9 OUTLIER -125.43 -29.12 3.26 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.235 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.458 HG21 HD11 ' B' ' 383' ' ' LEU . 6.8 mm -142.88 44.2 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -178.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.523 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -142.48 74.77 0.33 Allowed Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.719 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.539 ' OH ' ' CG ' ' B' ' 444' ' ' GLN . 0.1 OUTLIER -100.41 -76.67 0.55 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.745 0.307 . . . . 0.0 110.803 179.876 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . 168.1 82.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.008 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 25.1 t 176.58 -69.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.618 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.477 HD13 ' HB2' ' B' ' 385' ' ' LEU . 1.6 pt? -41.99 -28.15 0.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.822 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' B' ' 407' ' ' GLY . 0.7 OUTLIER 62.93 53.27 2.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.748 -179.721 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.536 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 6.1 tt -76.7 127.6 33.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.664 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.502 ' N ' HD22 ' B' ' 385' ' ' LEU . 14.3 p-80 -152.07 140.83 20.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.52 0.676 . . . . 0.0 112.366 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.499 ' CZ ' ' SG ' ' B' ' 404' ' ' CYS . 40.5 m-85 -91.89 160.65 15.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.869 179.347 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.55 HG21 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -136.97 138.25 46.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.118 179.067 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 389' ' ' THR . . . . . 0.525 ' CG2' ' O ' ' B' ' 389' ' ' THR . 0.4 OUTLIER -100.08 113.49 26.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.708 -179.786 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.478 ' O ' HG21 ' B' ' 401' ' ' ILE . 32.0 m -122.52 147.37 26.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.413 0.625 . . . . 0.0 111.42 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.539 ' CB ' HG22 ' B' ' 401' ' ' ILE . 9.3 tmtt? 80.55 55.97 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.961 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.444 ' C ' ' O ' ' B' ' 391' ' ' LYS . 2.8 mmtt -34.55 142.69 0.23 Allowed Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.672 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.453 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 14.6 Cg_exo -65.67 162.95 32.18 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.214 1.943 . . . . 0.0 111.845 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 22.8 p -132.29 158.99 40.43 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.855 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -82.01 7.66 12.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.517 179.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.465 ' O ' ' OD1' ' B' ' 397' ' ' ASP . 20.5 m -128.67 -15.72 2.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.313 178.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.465 ' OD1' ' O ' ' B' ' 396' ' ' VAL . 1.3 m-20 -158.83 65.41 2.88 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.543 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.453 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 74.7 Cg_exo -40.86 -40.31 3.56 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 123.607 2.871 . . . . 0.0 114.092 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.505 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 3.0 p-10 -33.74 140.7 0.05 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.049 0.452 . . . . 0.0 111.502 -178.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 2.7 m -143.23 163.0 34.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.466 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.539 HG22 ' CB ' ' B' ' 391' ' ' LYS . 0.5 OUTLIER -123.74 140.92 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 121.211 0.529 . . . . 0.0 111.557 -179.273 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.53 ' CG2' ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -102.84 179.3 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.121 179.479 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.55 ' CB ' HG21 ' B' ' 388' ' ' VAL . 0.1 OUTLIER -149.97 108.38 3.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.024 0.44 . . . . 0.0 110.531 178.902 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.521 ' O ' HG12 ' B' ' 411' ' ' VAL . 1.8 t -82.55 116.88 22.17 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.569 ' HA ' ' O ' ' B' ' 410' ' ' THR . 2.5 ptm180 -152.16 172.32 16.54 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.416 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.536 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 3.7 m -139.86 138.37 38.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.895 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' B' ' 384' ' ' ARG . . . -35.66 -36.83 0.12 Allowed Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 116.105 -0.498 . . . . 0.0 113.326 -179.26 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -55.55 -17.51 5.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.046 0.45 . . . . 0.0 110.382 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 95.66 45.81 2.85 Favored Glycine 0 N--CA 1.445 -0.718 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.625 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.569 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 37.4 m -131.55 112.59 12.76 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 -179.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.521 HG12 ' O ' ' B' ' 404' ' ' CYS . 30.4 t -84.43 86.64 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.416 179.006 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.52 HD23 ' CG1' ' B' ' 406' ' ' VAL . 0.0 OUTLIER -46.36 -23.1 0.31 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.98 -179.528 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.27 -154.51 25.4 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.042 -1.075 . . . . 0.0 113.383 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.481 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 3.3 m -155.99 154.64 31.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.73 -0.235 . . . . 0.0 110.472 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.539 ' O ' ' CD1' ' B' ' 401' ' ' ILE . . . -139.94 160.81 26.28 Favored Glycine 0 C--O 1.224 -0.523 0 C-N-CA 119.691 -1.242 . . . . 0.0 113.981 -179.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 1.4 p -146.52 145.57 19.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.505 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -161.69 132.71 2.92 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.061 -1.066 . . . . 0.0 113.246 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.514 ' N ' HD13 ' B' ' 422' ' ' ILE . 6.6 ttm180 -54.33 -53.58 51.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.948 0.404 . . . . 0.0 110.896 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.562 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.1 OUTLIER -79.48 -15.88 57.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.136 179.343 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.562 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 93.23 -42.69 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.159 0 C-N-CA 123.434 0.693 . . . . 0.0 111.536 -179.514 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.562 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.1 OUTLIER -52.63 -45.89 66.82 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.01 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.598 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -52.95 -36.58 24.17 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.691 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 177.648 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.53 ' O ' ' CG2' ' B' ' 402' ' ' VAL . . . -66.75 -43.4 84.23 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.556 178.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.87 -64.95 3.3 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.258 -0.972 . . . . 0.0 111.144 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . . . . . . . . . 53.6 mt -52.97 -41.54 41.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.852 0.358 . . . . 0.0 110.471 179.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.598 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 6.4 tpt180 -57.66 -55.86 29.37 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.497 ' HA ' ' OD1' ' B' ' 430' ' ' ASN . . . -40.81 -44.88 2.34 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.527 ' CB ' ' HB3' ' B' ' 370' ' ' ALA . . . -53.04 -62.96 1.31 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.648 178.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.483 ' HA ' HD11 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -48.29 -31.83 6.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.35 179.117 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.497 ' OD1' ' HA ' ' B' ' 427' ' ' ALA . 9.1 m120 -67.56 -31.69 71.93 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.785 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.495 ' HB2' ' OH ' ' B' ' 387' ' ' TYR . . . -70.96 -48.26 54.38 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.763 0.316 . . . . 0.0 110.643 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.55 ' CD2' ' C ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -89.94 14.38 12.31 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.756 179.486 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . 0.53 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 8.6 ttt-85 -86.08 3.28 43.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.426 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.493 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 3.7 t70 -126.5 92.39 3.55 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.115 0.484 . . . . 0.0 111.011 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.541 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -55.86 -32.88 64.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.668 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.541 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 15.6 mtmm -66.92 -59.22 3.7 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.518 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.519 ' SD ' ' CD1' ' B' ' 412' ' ' LEU . 0.9 OUTLIER -55.53 -51.78 65.89 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.286 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.543 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 96.0 mt -53.58 -65.65 0.53 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 178.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -42.09 -37.56 1.44 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.366 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.533 ' C ' ' CD1' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -63.81 -42.77 97.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.633 179.439 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.526 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 50.4 m-85 -71.91 -35.8 69.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.262 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.72 -48.37 63.62 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -38.59 90.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.628 178.479 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.539 ' CG ' ' OH ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -64.96 -23.16 67.14 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.233 179.516 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.514 ' CZ ' ' HB3' ' B' ' 380' ' ' TYR . 13.7 tpt180 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.143 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.467 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.5 OUTLIER . . . . . 0 C--O 1.236 0.361 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.486 ' HA ' ' HD2' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -29.94 -65.06 0.11 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.947 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.459 ' OD1' ' HE2' ' B' ' 368' ' ' MET . 2.9 m120 -42.27 -49.22 5.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.798 0.332 . . . . 0.0 110.486 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.467 ' N ' ' O ' ' B' ' 367' ' ' ASP . . . -58.95 -79.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.42 179.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.486 ' HD2' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -36.22 -40.97 0.24 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.086 0.47 . . . . 0.0 110.17 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.539 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.2 tmm_? -59.4 -63.52 1.27 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.278 179.221 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.524 ' HG3' ' CB ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -45.56 -34.98 3.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.394 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.517 ' CD2' HD22 ' B' ' 432' ' ' LEU . 1.3 mt -68.44 -76.73 0.09 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . 0.494 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.9 m-30 -84.91 21.58 1.56 Allowed 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.118 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -131.02 -36.7 1.32 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.731 0.3 . . . . 0.0 111.04 179.706 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 2.1 mp -102.89 -27.55 12.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.161 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.548 HG13 ' CD2' ' B' ' 438' ' ' LEU . 3.6 mm -139.91 37.43 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.134 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.444 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.494 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -126.52 93.36 0.4 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.351 -0.928 . . . . 0.0 112.909 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.464 ' CD2' ' HG2' ' B' ' 445' ' ' ARG . 42.8 p90 -105.43 -169.72 1.64 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.712 0.292 . . . . 0.0 110.291 179.335 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.613 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -87.19 109.41 19.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.26 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.613 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 10.7 t 104.1 37.26 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.755 0.66 . . . . 0.0 111.782 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.541 ' CD1' ' O ' ' B' ' 378' ' ' ILE . 2.8 tt -87.43 -49.43 7.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.11 0.481 . . . . 0.0 110.056 179.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.472 ' HB3' ' HA3' ' B' ' 407' ' ' GLY . 0.0 OUTLIER 72.08 35.7 1.24 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.406 178.758 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.573 HD21 ' CD1' ' B' ' 387' ' ' TYR . 0.3 OUTLIER -40.21 140.8 0.56 Allowed 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.617 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.556 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 1.4 t60 -128.24 83.31 2.15 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 -178.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.591 ' CE1' ' SG ' ' B' ' 404' ' ' CYS . 3.9 m-85 -83.84 116.98 23.0 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.104 177.275 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.82 113.78 44.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.9 0.381 . . . . 0.0 111.074 -179.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 54.3 m -77.37 127.92 33.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.348 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.489 HG23 ' CG2' ' B' ' 401' ' ' ILE . 31.8 m -134.6 151.54 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.097 0.475 . . . . 0.0 111.448 -179.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' B' ' 390' ' ' VAL . 10.7 tppt? 83.31 54.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.952 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.442 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER -34.95 142.83 0.24 Allowed Pre-proline 0 C--N 1.332 -0.153 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.415 179.842 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.513 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 2.7 Cg_exo -74.3 155.54 46.36 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 122.34 2.027 . . . . 0.0 113.434 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.461 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 1.7 p -138.69 165.96 25.61 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.507 -1.224 . . . . 0.0 111.762 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -86.89 12.9 9.99 Favored 'General case' 0 CA--C 1.527 0.088 0 CA-C-O 121.33 0.586 . . . . 0.0 110.276 178.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 3.7 m -138.52 18.91 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.507 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.43 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 0.8 OUTLIER 162.77 55.82 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.28 -179.538 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.513 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 3.9 Cg_endo -46.52 -48.79 13.0 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 123.623 2.882 . . . . 0.0 112.745 -179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.558 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -32.57 130.28 0.18 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.028 -178.814 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 13.8 m -132.58 159.51 39.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.392 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.489 ' CG2' HG23 ' B' ' 390' ' ' VAL . 16.8 tt -117.32 164.79 13.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.962 0.41 . . . . 0.0 111.221 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.507 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.2 OUTLIER -135.69 138.67 47.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.013 -179.001 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.49 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 6.5 mt-10 -101.35 126.15 48.07 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.591 ' SG ' ' CE1' ' B' ' 387' ' ' TYR . 19.0 t -109.03 102.35 11.34 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.556 ' O ' ' CB ' ' B' ' 386' ' ' HIS . 17.9 ptt180 -143.45 111.47 6.12 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.352 0.596 . . . . 0.0 111.485 -178.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.527 HG13 ' CD2' ' B' ' 383' ' ' LEU . 10.2 m -59.05 150.3 5.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.597 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . 0.472 ' HA3' ' HB3' ' B' ' 384' ' ' ARG . . . -52.5 -15.72 3.13 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.003 -0.999 . . . . 0.0 113.908 -179.129 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.14 -2.92 14.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.794 0.33 . . . . 0.0 110.564 179.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 86.74 41.79 6.66 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.618 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.536 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 21.5 m -140.72 125.37 17.95 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.803 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.499 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 54.9 t -87.46 112.58 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.309 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' B' ' 404' ' ' CYS . 1.2 mm? -67.75 -41.02 84.03 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . -177.42 -149.05 7.61 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.573 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.494 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -151.08 173.94 13.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.733 0.301 . . . . 0.0 110.906 -179.803 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.475 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -162.09 122.65 1.12 Allowed Glycine 0 C--O 1.227 -0.327 0 C-N-CA 120.186 -1.007 . . . . 0.0 113.066 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.464 ' HA ' ' HB1' ' B' ' 423' ' ' ALA . 6.4 p -126.67 149.42 31.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.805 0.336 . . . . 0.0 110.606 179.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.558 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -163.5 158.08 30.42 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.024 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.459 ' N ' HD12 ' B' ' 422' ' ' ILE . 8.8 ptt180 -63.2 -42.26 99.28 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.624 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.9 OUTLIER -101.46 30.15 4.41 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 179.418 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.555 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.55 -43.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 115.37 1.618 . . . . 0.0 115.37 178.402 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.624 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -48.91 -47.29 43.49 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.711 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.596 ' N ' ' CD ' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -49.45 -38.34 12.33 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.541 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.555 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -61.92 -48.32 80.98 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.627 178.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.425 ' HA2' HG22 ' B' ' 402' ' ' VAL . . . -63.33 -65.36 3.13 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.319 -0.943 . . . . 0.0 111.404 179.042 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.509 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 0.8 OUTLIER -50.37 -32.76 9.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.893 0.377 . . . . 0.0 109.994 178.925 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.593 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 27.6 tpt180 -65.46 -48.07 73.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.929 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.507 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -48.91 -42.1 35.83 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.425 ' CB ' ' HB3' ' B' ' 370' ' ' ALA . . . -58.07 -60.1 4.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.707 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.468 ' O ' ' HG ' ' B' ' 432' ' ' LEU . 14.6 mm-40 -48.73 -33.09 9.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.012 179.143 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.494 ' ND2' ' O ' ' B' ' 414' ' ' THR . 1.2 m-80 -65.02 -39.08 92.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.289 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.503 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -62.33 -41.75 98.81 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.156 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.524 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -87.33 0.37 55.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.795 179.414 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . 0.465 ' HG2' ' O ' ' B' ' 433' ' ' ARG . 54.8 ttt-85 -88.28 16.45 6.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.977 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -129.21 76.54 1.73 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.131 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.49 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -51.4 -32.54 26.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.097 0.475 . . . . 0.0 109.87 179.524 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.49 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -69.82 -42.37 73.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.092 179.642 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.411 ' SD ' ' CE1' ' B' ' 441' ' ' TYR . 13.2 tmm? -76.89 -44.73 30.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.027 179.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.548 ' CD2' HG13 ' B' ' 378' ' ' ILE . 68.1 mt -52.84 -67.69 0.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -53.36 -42.66 67.08 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.681 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.478 ' CB ' ' O ' ' B' ' 436' ' ' LYS . 2.5 t80 -53.7 -32.52 52.19 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.494 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 3.7 m-85 -78.7 -30.37 46.01 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.03 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -52.87 -39.52 62.69 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 177.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.15 -42.09 60.49 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.248 177.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.494 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -63.21 -13.8 41.73 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.406 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.464 ' HG2' ' CD2' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.191 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.665 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.547 ' OD1' ' N ' ' B' ' 367' ' ' ASP . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.329 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.498 ' N ' ' HE2' ' B' ' 371' ' ' LYS . 10.8 ptm -34.74 -43.14 0.17 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.407 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -64.08 -49.85 70.66 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.024 0.44 . . . . 0.0 109.83 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.525 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -53.73 -78.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.107 179.042 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.498 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -32.5 -50.69 0.25 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.091 -179.587 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.541 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -51.96 -45.42 64.4 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.413 179.766 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.535 ' HG3' ' CB ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -58.93 -52.08 67.27 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.366 0.603 . . . . 0.0 110.898 179.775 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.521 ' CD2' HD22 ' B' ' 432' ' ' LEU . 1.5 mt -53.68 -73.85 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -82.65 -33.67 27.73 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.541 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -82.1 -16.38 50.18 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.111 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.522 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.4 OUTLIER -120.19 -24.77 5.87 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.357 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.522 ' O ' ' N ' ' B' ' 380' ' ' TYR . 27.7 mm -124.13 -65.83 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 C-N-CA 120.796 -0.362 . . . . 0.0 111.949 -179.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' B' ' 374' ' ' LEU . . . -56.29 79.06 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.459 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.543 ' O ' ' CB ' ' B' ' 381' ' ' ALA . 2.5 p90 -60.55 -41.46 94.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.498 0.19 . . . . 0.0 111.169 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.543 ' CB ' ' O ' ' B' ' 380' ' ' TYR . . . 154.99 -20.3 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.893 0.378 . . . . 0.0 111.169 179.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 1.7 m -127.29 39.62 3.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.69 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.542 HD11 ' CE1' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -99.2 -36.3 9.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.068 -179.858 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 76.52 48.27 0.07 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.051 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.552 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 9.6 tt -89.39 143.11 27.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.56 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 14.3 p-80 -164.12 138.27 5.57 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.481 0.658 . . . . 0.0 112.576 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.486 ' HA ' ' O ' ' B' ' 403' ' ' GLU . 15.2 m-85 -98.48 142.14 30.46 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.077 178.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.517 ' O ' ' N ' ' B' ' 390' ' ' VAL . 0.1 OUTLIER -122.29 116.72 49.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.896 -179.793 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 389' ' ' THR . . . . . 0.407 ' O ' HG22 ' B' ' 389' ' ' THR . 18.2 m -60.0 85.99 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 177.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.587 ' CG1' HG23 ' B' ' 401' ' ' ILE . 1.6 p -83.43 132.15 32.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.25 -0.887 . . . . 0.0 111.448 -177.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.537 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.9 OUTLIER 90.88 132.88 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.546 -178.348 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.463 ' N ' ' HD3' ' B' ' 391' ' ' LYS . 1.5 mmmm -85.56 123.06 73.19 Favored Pre-proline 0 N--CA 1.464 0.244 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.343 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.465 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 2.9 Cg_exo -74.64 164.07 34.53 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.979 2.453 . . . . 0.0 113.357 -179.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -107.74 -158.74 0.66 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.342 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -89.13 -48.53 7.33 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.551 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.515 ' C ' ' CD ' ' B' ' 398' ' ' PRO . 2.7 m -111.74 -13.1 11.38 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-O 121.658 0.742 . . . . 0.0 110.266 179.161 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.564 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 0.8 OUTLIER -115.44 44.95 0.39 Allowed Pre-proline 0 C--N 1.318 -0.776 0 CA-C-N 114.53 -1.213 . . . . 0.0 110.966 179.888 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' B' ' 397' ' ' ASP . 13.7 Cg_exo -45.67 -22.21 1.09 Allowed 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.533 2.156 . . . . 0.0 112.062 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' B' ' 398' ' ' PRO . 0.2 OUTLIER -20.26 88.64 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.295 0 O-C-N 123.665 0.603 . . . . 0.0 111.233 179.997 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 400' ' ' SER . . . . . 0.479 ' N ' ' O ' ' B' ' 398' ' ' PRO . 18.0 t -119.21 159.87 23.23 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.283 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.587 HG23 ' CG1' ' B' ' 390' ' ' VAL . 13.6 tt -112.26 160.61 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-O 121.476 0.655 . . . . 0.0 111.003 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.484 ' O ' ' OG1' ' B' ' 414' ' ' THR . 0.4 OUTLIER -120.25 142.04 37.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.786 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.566 ' N ' HG13 ' B' ' 390' ' ' VAL . 0.3 OUTLIER -106.11 121.33 43.94 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.461 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.565 ' O ' ' N ' ' B' ' 412' ' ' LEU . 2.6 m -101.76 105.93 16.87 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.495 ' HA ' ' HA ' ' B' ' 411' ' ' VAL . 1.6 ptm180 -138.01 -179.94 6.07 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.364 0.602 . . . . 0.0 112.357 -178.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.552 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -148.63 139.75 17.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.02 -179.431 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . 0.465 ' O ' ' CG ' ' B' ' 408' ' ' ASP . . . 56.29 16.29 14.06 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.15 -1.024 . . . . 0.0 110.737 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . 0.47 ' O ' ' OD1' ' B' ' 408' ' ' ASP . 1.9 p30 55.29 32.98 19.74 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.226 0.536 . . . . 0.0 110.336 -179.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -140.26 -26.64 0.23 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.517 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.479 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 44.6 m -121.24 110.92 16.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 117.143 0.471 . . . . 0.0 112.226 -179.234 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.495 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 60.1 t -86.53 111.63 21.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.336 178.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.565 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.3 OUTLIER -66.85 -37.74 85.03 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.248 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . -178.67 -143.44 5.25 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.452 -0.88 . . . . 0.0 112.408 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.523 ' OG1' ' CD1' ' B' ' 401' ' ' ILE . 11.5 t -176.1 170.1 2.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.557 0.218 . . . . 0.0 110.886 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.478 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -161.18 146.43 12.29 Favored Glycine 0 C--O 1.226 -0.398 0 C-N-CA 120.348 -0.929 . . . . 0.0 112.804 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.472 ' CG2' ' HB ' ' B' ' 401' ' ' ILE . 54.7 t -121.34 155.05 25.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.813 0.339 . . . . 0.0 110.704 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.549 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -165.05 141.32 6.97 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.128 -1.034 . . . . 0.0 113.117 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.471 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -63.62 -41.54 98.27 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.722 0.296 . . . . 0.0 111.047 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.604 ' O ' ' N ' ' B' ' 421' ' ' LYS . 8.6 p30 -102.47 29.68 5.09 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.509 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.538 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 47.81 -44.42 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 178.629 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.604 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -48.37 -48.95 36.31 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 119.116 0.871 . . . . 0.0 108.676 -179.398 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.593 ' N ' ' CD ' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -47.52 -38.21 5.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.533 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -66.29 -43.2 86.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.493 178.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.48 -67.25 2.14 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.774 -0.727 . . . . 0.0 111.978 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.446 HG21 ' CG ' ' B' ' 367' ' ' ASP . 5.0 mm -50.25 -59.38 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.825 0.345 . . . . 0.0 111.205 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.564 ' HG3' ' N ' ' B' ' 427' ' ' ALA . 0.0 OUTLIER -49.36 -44.47 44.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.21 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.564 ' N ' ' HG3' ' B' ' 426' ' ' ARG . . . -47.4 -51.67 19.11 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.457 ' HA ' ' OH ' ' B' ' 387' ' ' TYR . . . -52.22 -50.9 61.04 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.828 179.15 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.495 ' HA ' ' CG ' ' B' ' 432' ' ' LEU . 40.2 mt-10 -56.22 -34.16 66.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.882 179.023 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.445 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.4 OUTLIER -59.91 -41.06 90.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.461 179.344 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.456 ' HB2' ' OH ' ' B' ' 387' ' ' TYR . . . -64.13 -42.55 96.77 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.234 0.54 . . . . 0.0 110.295 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.535 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -84.26 7.03 20.54 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.482 179.328 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 10.0 mtt180 -94.86 14.3 21.95 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.084 0.468 . . . . 0.0 110.969 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.534 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 67.4 m-20 -125.73 78.27 1.73 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.821 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.553 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 8.6 ptpt -46.85 -53.55 11.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.047 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.553 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.3 mttt -55.65 -40.54 72.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 0.0 110.695 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.534 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 0.1 OUTLIER -71.91 -46.7 56.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.317 179.546 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.432 ' CD2' HG13 ' B' ' 378' ' ' ILE . 72.2 mt -57.95 -61.69 2.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.002 179.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -54.27 -33.23 58.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.906 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.462 ' HB3' ' O ' ' B' ' 437' ' ' MET . 5.8 t80 -59.21 -38.57 80.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.493 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.469 ' HA ' ' HB2' ' B' ' 444' ' ' GLN . 53.2 m-85 -79.42 -27.2 41.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.112 179.029 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -59.66 -52.48 65.35 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.9 -47.17 86.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 177.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.469 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -59.82 -17.01 32.76 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.15 178.591 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.196 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.343 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.463 ' O ' ' HD3' ' B' ' 371' ' ' LYS . 3.4 p30 . . . . . 0 C--O 1.236 0.364 0 CA-C-O 120.919 0.39 . . . . 0.0 110.965 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.51 ' CE ' ' CG ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -54.37 -55.16 31.34 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.824 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.51 ' CG ' ' CE ' ' B' ' 368' ' ' MET . 16.1 m120 -55.18 -37.74 67.44 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.459 ' HA ' ' CD2' ' B' ' 432' ' ' LEU . . . -49.87 -78.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.746 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.463 ' HD3' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -41.68 -42.16 2.45 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.33 0.586 . . . . 0.0 109.939 179.606 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.557 ' O ' ' CB ' ' B' ' 376' ' ' SER . 13.7 ttp180 -55.64 -46.82 77.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.484 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.551 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -57.29 -47.07 82.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.437 0.637 . . . . 0.0 110.49 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.481 ' CD2' ' N ' ' B' ' 374' ' ' LEU . 1.3 mt -51.63 -70.57 0.08 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.58 -179.029 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . 0.431 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.3 m-85 -84.97 -42.08 15.27 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -177.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.9 OUTLIER -65.41 -29.3 69.98 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.551 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 4.3 mm? -110.94 -44.58 3.59 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.886 -179.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.55 HG13 ' CD2' ' B' ' 438' ' ' LEU . 0.9 OUTLIER -118.45 51.59 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.983 0.421 . . . . 0.0 111.432 -179.185 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.431 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -140.22 44.6 1.05 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.219 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.627 ' CD1' ' N ' ' B' ' 381' ' ' ALA . 23.5 p90 -91.03 -45.93 8.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.678 0.275 . . . . 0.0 111.169 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.627 ' N ' ' CD1' ' B' ' 380' ' ' TYR . . . 160.85 -168.0 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.266 0.555 . . . . 0.0 111.638 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 5.7 t 43.91 22.27 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.562 -0.745 . . . . 0.0 112.083 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.529 ' O ' HG12 ' B' ' 406' ' ' VAL . 2.0 pt? -127.39 -0.49 6.3 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.469 ' HB2' ' HA2' ' B' ' 407' ' ' GLY . 1.3 mmt180 29.95 49.48 0.06 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.344 179.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.571 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 0.4 OUTLIER -59.94 129.76 43.39 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 121.073 0.464 . . . . 0.0 111.411 -179.505 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.581 ' CD2' ' O ' ' B' ' 386' ' ' HIS . 24.0 p-80 -167.79 108.88 0.59 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.154 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.487 ' CE2' ' HB3' ' B' ' 427' ' ' ALA . 2.8 m-85 -55.76 175.55 0.08 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.149 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.42 ' N ' ' O ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -157.54 101.87 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.743 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 31.4 m -77.18 106.32 8.83 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.661 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.549 ' CG2' ' O ' ' B' ' 401' ' ' ILE . 28.4 m -112.42 150.43 14.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 0.0 110.678 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.58 ' CB ' ' CG2' ' B' ' 401' ' ' ILE . 8.2 tppt? 72.44 48.97 0.22 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.38 -179.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' B' ' 391' ' ' LYS . 2.2 mtmt -33.79 143.64 0.18 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.194 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.472 ' HG3' HG23 ' B' ' 420' ' ' ILE . 32.3 Cg_exo -58.23 179.98 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.954 2.436 . . . . 0.0 112.499 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.532 ' OG1' ' N ' ' B' ' 397' ' ' ASP . 0.1 OUTLIER -160.84 155.42 23.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.089 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -59.24 -23.27 62.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.138 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 2.8 m -123.96 13.44 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.234 0.54 . . . . 0.0 110.264 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.532 ' N ' ' OG1' ' B' ' 394' ' ' THR . 0.8 OUTLIER -157.51 51.96 0.53 Allowed Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.468 179.645 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.525 ' HD3' ' N ' ' B' ' 397' ' ' ASP . 85.4 Cg_exo -46.65 -29.02 7.14 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.788 2.325 . . . . 0.0 112.396 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.484 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 20.8 p-10 -53.27 132.0 38.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.258 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -135.37 144.33 46.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.123 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.58 ' CG2' ' CB ' ' B' ' 391' ' ' LYS . 0.6 OUTLIER -107.29 100.17 10.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-O 121.213 0.53 . . . . 0.0 111.223 -179.463 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.516 ' CG2' ' O ' ' B' ' 423' ' ' ALA . 0.4 OUTLIER -72.39 163.2 4.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.048 179.716 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.499 ' HG2' ' N ' ' B' ' 404' ' ' CYS . 44.9 tt0 -148.9 158.49 44.21 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.79 ' O ' ' O ' ' B' ' 411' ' ' VAL . 24.3 t -132.49 130.72 40.83 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 178.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -129.79 126.99 39.43 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 123.697 0.623 . . . . 0.0 110.776 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.571 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -124.64 134.23 67.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.516 -179.287 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . 0.469 ' HA2' ' HB2' ' B' ' 384' ' ' ARG . . . 64.18 5.78 17.06 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.754 -0.736 . . . . 0.0 111.866 -179.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 66.48 68.61 0.43 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 163.87 -46.51 0.31 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.113 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.486 ' CG2' ' CD1' ' B' ' 412' ' ' LEU . 12.0 m -86.78 113.47 22.64 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.79 ' O ' ' O ' ' B' ' 404' ' ' CYS . 3.9 t -76.6 -60.93 1.91 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 -177.026 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.553 ' CD2' HG22 ' B' ' 406' ' ' VAL . 0.1 OUTLIER 63.9 -39.2 0.21 Allowed 'General case' 0 C--N 1.315 -0.893 0 O-C-N 120.144 -1.598 . . . . 0.0 111.569 -178.51 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.557 ' HA3' ' CB ' ' B' ' 404' ' ' CYS . . . -112.97 127.5 7.97 Favored Glycine 0 C--N 1.35 1.326 0 C-N-CA 119.511 -1.328 . . . . 0.0 113.774 -179.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.523 ' N ' ' OD1' ' B' ' 430' ' ' ASN . 0.2 OUTLIER -165.84 63.16 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.709 0.29 . . . . 0.0 111.295 179.431 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.55 ' O ' ' CD1' ' B' ' 401' ' ' ILE . . . -109.82 172.81 16.18 Favored Glycine 0 C--O 1.226 -0.368 0 C-N-CA 120.407 -0.901 . . . . 0.0 113.667 -178.411 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 5.7 p -131.96 166.76 28.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.583 0.23 . . . . 0.0 110.628 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.484 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -172.81 116.25 0.6 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.092 -1.052 . . . . 0.0 113.184 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.543 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -43.69 -68.2 0.22 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.713 0.292 . . . . 0.0 110.386 179.324 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.616 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.2 OUTLIER -66.6 -20.57 66.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.039 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.616 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 1.1 pp 102.29 -39.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 124.387 1.075 . . . . 0.0 111.37 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -49.63 -52.04 33.49 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.75 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.576 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -47.49 -33.27 2.96 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.519 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 177.417 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.523 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -74.22 -34.44 63.69 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.478 179.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -70.58 -56.24 7.71 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.149 -1.024 . . . . 0.0 111.152 178.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . . . . . . . . . 3.5 mp -63.77 -42.93 97.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.729 0.299 . . . . 0.0 110.446 179.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.576 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 17.8 tpt180 -53.51 -53.01 57.59 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.521 ' O ' ' CB ' ' B' ' 430' ' ' ASN . . . -51.57 -40.23 59.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.509 ' O ' ' N ' ' B' ' 431' ' ' ALA . . . -52.49 -74.21 0.04 OUTLIER 'General case' 0 C--O 1.236 0.393 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.539 ' HA ' ' CD2' ' B' ' 432' ' ' LEU . 3.3 mt-10 -43.04 -36.28 1.55 Allowed 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.551 ' HB3' ' HA2' ' B' ' 413' ' ' GLY . 0.3 OUTLIER -53.2 -36.86 61.42 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.263 178.954 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.552 ' O ' ' CE ' ' B' ' 437' ' ' MET . . . -83.51 -18.96 36.67 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 120.911 0.386 . . . . 0.0 110.782 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.539 ' CD2' ' HA ' ' B' ' 429' ' ' GLU . 0.8 OUTLIER -115.81 21.58 13.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.177 0.513 . . . . 0.0 109.965 178.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' B' ' 429' ' ' GLU . 38.0 mtt-85 -109.63 3.15 20.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.043 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.446 ' OD2' ' HA ' ' B' ' 412' ' ' LEU . 43.8 m-20 -106.37 77.07 1.18 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.303 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.523 ' HG3' ' N ' ' B' ' 436' ' ' LYS . 5.5 ptpp? -38.89 -48.08 1.51 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.558 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.523 ' N ' ' HG3' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -57.57 -51.56 68.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.043 -179.716 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.552 ' CE ' ' O ' ' B' ' 431' ' ' ALA . 15.4 tmm? -61.43 -56.59 18.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.146 0.498 . . . . 0.0 110.0 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.55 ' CD2' HG13 ' B' ' 378' ' ' ILE . 60.4 mt -47.81 -64.77 0.7 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.882 178.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -54.92 -25.22 27.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.465 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.471 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -69.83 -39.08 76.67 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.362 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.532 ' HA ' ' HB2' ' B' ' 444' ' ' GLN . 32.4 m-85 -76.01 -51.97 11.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.174 179.118 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' B' ' 445' ' ' ARG . . . -44.45 -46.31 9.56 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -40.06 91.59 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.532 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -68.64 -7.18 30.77 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.49 178.917 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.593 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.411 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.468 ' O ' ' HD2' ' B' ' 371' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.162 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.569 ' CE ' ' HB3' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -48.14 -48.95 33.86 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.981 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.569 ' HB3' ' CE ' ' B' ' 368' ' ' MET . 0.5 OUTLIER -66.12 -25.72 67.12 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 178.786 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.473 ' HA ' HD23 ' B' ' 432' ' ' LEU . . . -58.99 -70.7 0.14 Allowed 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.468 ' HD2' ' O ' ' B' ' 367' ' ' ASP . 0.1 OUTLIER -48.74 -33.27 9.91 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.317 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.548 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -58.88 -46.64 87.33 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.867 -1.061 . . . . 0.0 109.959 178.839 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.512 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -63.02 -45.54 91.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.497 -179.785 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.557 ' CD2' HD21 ' B' ' 432' ' ' LEU . 0.4 OUTLIER -57.55 -69.52 0.16 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -178.118 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -83.93 -33.97 24.57 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -177.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.548 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.2 OUTLIER -81.97 -21.25 37.26 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.601 -0.44 . . . . 0.0 112.152 -178.932 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 2.3 mm? -123.83 -6.59 7.93 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.603 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.54 ' O ' ' N ' ' B' ' 380' ' ' TYR . 9.3 mm -145.6 -117.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 119.341 -0.361 . . . . 0.0 111.411 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.527 ' C ' ' O ' ' B' ' 378' ' ' ILE . . . -0.68 68.28 0.0 OUTLIER Glycine 0 C--N 1.346 1.096 0 N-CA-C 114.393 0.517 . . . . 0.0 114.393 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.547 ' CD1' ' HG2' ' B' ' 445' ' ' ARG . 0.1 OUTLIER -82.58 -78.07 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.02 0.438 . . . . 0.0 111.494 -179.764 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.421 ' CB ' ' O ' ' B' ' 380' ' ' TYR . . . 164.36 50.28 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.091 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -147.34 6.55 0.86 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.623 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.579 ' CD1' ' N ' ' B' ' 383' ' ' LEU . 0.0 OUTLIER -152.42 18.51 0.63 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.179 0.514 . . . . 0.0 110.77 179.834 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 32.77 73.56 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.671 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.495 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.2 OUTLIER -59.52 114.17 2.57 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 177.791 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -122.2 102.46 8.15 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -176.157 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.47 ' OH ' ' HB1' ' B' ' 431' ' ' ALA . 13.2 m-85 -76.43 165.37 24.92 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 175.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.539 HG21 ' O ' ' B' ' 403' ' ' GLU . 0.2 OUTLIER -148.52 167.95 3.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 C-N-CA 120.131 -0.628 . . . . 0.0 111.003 178.95 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 7.7 m -130.54 118.12 20.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.92 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.532 ' O ' HG22 ' B' ' 401' ' ' ILE . 20.3 m -130.03 153.4 38.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.799 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.43 ' HB2' ' CG2' ' B' ' 401' ' ' ILE . 0.1 OUTLIER 65.61 61.24 0.69 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.22 -179.779 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.19 139.19 56.08 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.472 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.516 ' HA ' ' HA ' ' B' ' 398' ' ' PRO . 11.0 Cg_endo -56.25 -172.89 0.04 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.574 2.183 . . . . 0.0 112.311 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.533 ' N ' ' HA ' ' B' ' 398' ' ' PRO . 54.9 p -157.02 -81.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.298 -0.41 . . . . 0.0 112.071 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . 167.76 -25.3 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 -179.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -116.22 -2.51 10.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.556 0.693 . . . . 0.0 110.16 178.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.438 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 1.3 m-20 179.06 56.39 0.06 OUTLIER Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.638 179.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.55 ' O ' ' O ' ' B' ' 399' ' ' ASN . 10.4 Cg_endo -54.57 -77.31 0.02 OUTLIER 'Trans proline' 0 CA--C 1.519 -0.251 0 C-N-CA 123.252 2.635 . . . . 0.0 112.884 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.55 ' O ' ' O ' ' B' ' 398' ' ' PRO . 0.4 OUTLIER 44.84 115.43 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.142 -179.542 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 400' ' ' SER . . . . . 0.475 ' O ' ' HB2' ' B' ' 423' ' ' ALA . 2.0 t -113.21 117.33 31.58 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.733 179.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.532 HG22 ' O ' ' B' ' 390' ' ' VAL . 0.5 OUTLIER -108.04 106.61 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 CA-C-O 121.305 0.574 . . . . 0.0 110.663 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.47 ' CG2' ' O ' ' B' ' 423' ' ' ALA . 0.3 OUTLIER -77.96 158.58 4.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.099 179.756 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.539 ' O ' HG21 ' B' ' 388' ' ' VAL . 7.2 tp10 -128.78 89.48 2.89 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.191 178.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.728 ' O ' ' O ' ' B' ' 411' ' ' VAL . 0.4 OUTLIER -82.42 114.83 21.13 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 178.076 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.528 ' HA ' ' O ' ' B' ' 411' ' ' VAL . 17.5 ptt85 -155.8 169.42 24.42 Favored 'General case' 0 C--O 1.226 -0.154 0 O-C-N 124.224 0.952 . . . . 0.0 109.744 -178.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.547 ' CG1' ' CD2' ' B' ' 412' ' ' LEU . 23.7 m -127.27 126.43 67.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.829 0.347 . . . . 0.0 111.772 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -35.05 -33.9 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 CA-C-N 115.709 -0.678 . . . . 0.0 113.314 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' B' ' 406' ' ' VAL . 15.1 t0 -59.47 -29.19 67.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.975 0.417 . . . . 0.0 110.675 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 118.03 47.26 0.44 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 121.038 -0.601 . . . . 0.0 111.769 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.509 ' HB ' ' CG2' ' B' ' 406' ' ' VAL . 0.2 OUTLIER -142.45 112.68 7.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.727 0.298 . . . . 0.0 111.402 -179.241 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.728 ' O ' ' O ' ' B' ' 404' ' ' CYS . 20.8 t -59.17 -63.7 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.55 ' HB2' ' O ' ' B' ' 411' ' ' VAL . 0.0 OUTLIER 86.09 -42.55 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 O-C-N 121.485 -0.759 . . . . 0.0 109.31 -178.336 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.518 ' O ' ' CB ' ' B' ' 404' ' ' CYS . . . 167.46 175.15 37.15 Favored Glycine 0 C--N 1.339 0.736 0 C-N-CA 119.61 -1.281 . . . . 0.0 113.742 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.49 ' OG1' ' N ' ' B' ' 415' ' ' GLY . 0.0 OUTLIER -142.63 -177.64 5.39 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.481 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.49 ' N ' ' OG1' ' B' ' 414' ' ' THR . . . -158.07 117.34 0.77 Allowed Glycine 0 C--O 1.223 -0.555 0 C-N-CA 118.742 -1.694 . . . . 0.0 114.273 -179.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' B' ' 400' ' ' SER . 38.3 t -107.45 145.07 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 178.34 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.482 ' HA3' HD11 ' B' ' 422' ' ' ILE . . . -166.91 145.94 10.36 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 119.531 -1.319 . . . . 0.0 113.467 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.449 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -66.44 -53.31 36.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 110.653 179.656 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.615 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.5 OUTLIER -79.73 -21.83 44.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.24 179.512 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.615 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 0.8 OUTLIER 99.07 -41.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 C-N-CA 124.038 0.935 . . . . 0.0 111.429 -179.215 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.592 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -50.32 -42.2 52.39 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.436 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.592 ' N ' ' CD ' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -56.72 -37.23 51.97 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.656 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 177.717 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.533 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -71.42 -31.55 67.37 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.145 179.061 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -71.39 -67.14 1.95 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.199 -1.001 . . . . 0.0 111.168 178.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.441 HD13 ' HG2' ' B' ' 421' ' ' LYS . 2.9 mp -51.66 -46.65 38.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 121.068 0.461 . . . . 0.0 110.207 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.566 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.4 tpt180 -54.25 -43.56 71.03 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.217 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.434 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -52.62 -49.99 63.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.175 179.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' B' ' 431' ' ' ALA . . . -54.75 -72.2 0.07 Allowed 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.22 0.533 . . . . 0.0 110.11 179.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.466 ' HA ' HD23 ' B' ' 432' ' ' LEU . 2.8 mt-10 -45.31 -28.02 0.76 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.936 179.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.521 ' ND2' ' HG3' ' B' ' 426' ' ' ARG . 0.6 OUTLIER -68.02 -34.12 75.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.333 179.4 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.513 ' N ' ' O ' ' B' ' 428' ' ' ALA . . . -65.24 -47.46 76.7 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.308 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.557 HD21 ' CD2' ' B' ' 374' ' ' LEU . 0.7 OUTLIER -88.28 20.23 3.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.565 179.667 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 8.4 ttt-85 -90.02 1.02 56.78 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.039 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.527 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 95.2 m-20 -114.69 76.09 0.97 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.67 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.449 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -39.33 -45.38 1.43 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 -179.716 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.449 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.2 mmpt? -63.36 -53.48 51.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.922 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.527 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 0.0 OUTLIER -60.14 -37.36 79.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.122 0.487 . . . . 0.0 109.97 179.501 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.493 ' CD2' ' HA ' ' B' ' 432' ' ' LEU . 58.6 mt -66.53 -55.62 14.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.213 179.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -64.62 -25.9 68.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.821 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.517 ' CE2' ' CE1' ' B' ' 441' ' ' TYR . 0.2 OUTLIER -69.4 -41.47 76.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.17 0.51 . . . . 0.0 109.663 179.34 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.544 ' CD1' ' OH ' ' B' ' 380' ' ' TYR . 16.0 m-85 -71.99 -39.87 68.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.707 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -54.79 -40.05 69.06 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . 0.442 ' O ' ' HE3' ' B' ' 443' ' ' LYS . 0.1 OUTLIER -69.94 -53.91 15.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.501 179.067 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.484 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -53.55 -30.38 41.55 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.182 0.515 . . . . 0.0 110.004 179.653 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.547 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.681 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.452 " O5'" ' H8 ' ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.694 0 C5'-C4'-C3' 111.036 -2.976 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.876 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.179 0 O4'-C1'-N19 111.181 2.981 . 0.189 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.876 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.174 0 O4'-C1'-N19 111.084 2.884 . 0.241 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.588 " C5'" HO2' ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.19 0 O4'-C1'-N19 111.317 3.117 . 0.259 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.625 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.928 0 O4'-C1'-N19 111.302 3.102 . 0.381 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.438 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.212 0 O4'-C1'-N19 111.251 3.051 . 0.096 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.871 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.847 0 C5'-C4'-C3' 111.013 -2.991 . 0.169 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.682 ' N4 ' ' N4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.235 0 O4'-C1'-N19 111.27 3.07 . 0.299 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.528 ' N6 ' ' O6 ' ' A' ' 25' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.299 0 O4'-C1'-N19 111.303 3.103 . 0.249 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.662 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.951 0 C5'-C4'-C3' 111.02 -2.987 . 0.113 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.635 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.331 0 O4'-C1'-N19 111.111 2.911 . 0.039 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.799 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.065 0 O4'-C1'-N19 111.268 3.068 . 0.084 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.799 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.155 0 O4'-C1'-N19 111.383 3.183 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.74 " H5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.429 -2.023 0 C5'-C4'-C3' 111.079 -2.948 . 0.059 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.536 ' C5 ' ' N4 ' ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.161 0 C5'-C4'-C3' 110.884 -3.077 . 0.129 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.582 " O4'" ' N6 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.711 0 O4'-C1'-N19 111.255 3.055 . 0.01 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.765 " O2'" ' P ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.888 0 O4'-C1'-N19 111.605 3.405 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.765 ' P ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 P--O5' 1.614 2.097 0 O4'-C1'-N19 111.183 2.983 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.466 " O4'" " O2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.299 0 O4'-C1'-N19 111.229 3.029 . 0.143 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.635 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.876 0 O4'-C1'-N19 111.275 3.075 . 0.0 OUTLIER '7D dist &a' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.699 ' H8 ' " O5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.766 0 O4'-C1'-N19 111.39 3.19 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.781 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.069 0 O4'-C1'-N19 111.162 2.962 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.762 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.281 0 O4'-C1'-N19 111.74 3.54 . 0.017 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.762 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.293 0 C5'-C4'-C3' 111.412 -2.725 . 0.091 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.614 ' C2 ' ' C5 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.681 0 C3'-C2'-C1' 105.049 3.943 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.802 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.178 0 O4'-C1'-N19 111.024 2.824 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.835 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.17 0 O4'-C1'-N19 111.159 2.959 . 0.201 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.835 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.358 0 C3'-C2'-C1' 104.202 3.002 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.807 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.258 0 O4'-C1'-N19 111.157 2.957 . 0.254 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.807 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.242 0 O4'-C1'-N19 111.598 3.398 . 0.156 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.671 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.655 0 O4'-C1'-N19 111.337 3.137 . 0.165 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.613 " C5'" HO2' ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.559 0 C5'-C4'-C3' 111.152 -2.899 . 0.072 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.224 0 N-CA-C 112.46 -0.256 . . . . 0.0 112.46 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 42.54 47.55 4.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.765 0.317 . . . . 0.0 110.862 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.443 HD22 ' ND2' ' B' ' 369' ' ' ASN . 7.2 tp -128.37 116.36 19.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.375 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.507 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.3 OUTLIER -55.74 -61.91 2.05 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.187 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.483 ' HE1' ' N ' ' B' ' 369' ' ' ASN . 3.0 ttp -32.49 -52.21 0.29 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.507 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.483 ' N ' ' HE1' ' B' ' 368' ' ' MET . 32.0 m-20 -58.65 -49.79 76.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.224 179.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.543 ' CB ' ' HB1' ' B' ' 428' ' ' ALA . . . -54.86 -79.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.275 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.467 ' C ' ' O ' ' B' ' 370' ' ' ALA . 0.2 OUTLIER -29.33 -45.15 0.04 OUTLIER 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.031 0.443 . . . . 0.0 111.016 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.58 ' HD2' ' N3 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -61.64 -61.64 2.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.323 179.551 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.522 ' HG3' ' CB ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -40.93 -34.55 0.42 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.221 0.534 . . . . 0.0 110.137 179.309 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' B' ' 379' ' ' GLY . 2.6 mt -68.29 -80.9 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.211 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.88 27.79 0.85 Allowed 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -178.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.525 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 1.1 p -135.92 -31.57 0.92 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.241 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 1.1 mm? -109.39 -27.85 9.26 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.485 ' CG1' HD22 ' B' ' 438' ' ' LEU . 19.0 mm -129.5 -62.5 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.804 -179.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.54 ' N ' ' O ' ' B' ' 374' ' ' LEU . . . -32.64 102.72 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.732 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.528 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 10.1 p90 -115.04 177.73 4.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.888 0.375 . . . . 0.0 110.831 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.448 ' O ' ' HB3' ' B' ' 382' ' ' SER . . . -65.99 118.14 9.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.213 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.448 ' HB3' ' O ' ' B' ' 381' ' ' ALA . 8.4 t 79.13 45.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.224 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.513 ' O ' ' CB ' ' B' ' 384' ' ' ARG . 0.1 OUTLIER -95.39 -42.16 8.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.809 0.338 . . . . 0.0 110.706 179.675 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.513 ' CB ' ' O ' ' B' ' 383' ' ' LEU . 3.8 tpm_? 84.56 -6.16 0.99 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.106 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.603 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 4.5 tt -36.02 129.5 0.66 Allowed 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.778 0.323 . . . . 0.0 110.583 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.449 ' N ' HD23 ' B' ' 385' ' ' LEU . 3.9 p-80 -161.22 147.37 14.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.647 0.737 . . . . 0.0 112.862 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.484 ' OH ' ' HA ' ' B' ' 428' ' ' ALA . 11.9 m-85 -105.12 141.95 35.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.97 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -121.72 123.29 69.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.091 0.472 . . . . 0.0 111.289 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.15 130.41 38.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.629 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.566 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 28.0 m -141.36 144.9 25.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.964 0.411 . . . . 0.0 110.915 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.566 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 7.9 tptt 95.68 56.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.531 -179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' B' ' 391' ' ' LYS . 4.2 mmpt? -31.21 107.41 0.25 Allowed Pre-proline 0 N--CA 1.462 0.154 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.206 -179.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.491 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 4.3 Cg_exo -44.98 159.53 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.799 2.333 . . . . 0.0 113.353 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 16.6 p -128.12 158.27 38.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.972 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . 0.501 ' O ' " O2'" ' A' ' 30' ' ' ' C' . . . -86.28 13.83 7.45 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.597 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 3.0 m -136.96 14.05 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.082 177.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 166.45 61.56 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 114.496 -1.229 . . . . 0.0 108.797 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.538 ' HB3' " C4'" ' A' ' 5' ' ' ' U' . 96.4 Cg_exo -42.8 -32.18 2.45 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.225 2.617 . . . . 0.0 113.086 -179.034 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.587 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.8 OUTLIER -30.67 127.21 0.15 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.022 -178.761 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 400' ' ' SER . . . . . 0.415 ' O ' HG23 ' B' ' 416' ' ' VAL . 47.7 t -136.55 166.92 22.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.848 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.457 HG21 ' O ' ' B' ' 390' ' ' VAL . 15.3 tt -122.51 161.98 22.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.105 0.478 . . . . 0.0 111.495 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.482 ' CG2' ' C ' ' B' ' 423' ' ' ALA . 0.1 OUTLIER -128.68 143.76 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.943 -179.624 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.439 ' HA ' HG22 ' B' ' 414' ' ' THR . 0.6 OUTLIER -110.69 125.78 53.84 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.774 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 412' ' ' LEU . 41.3 t -106.18 107.21 18.1 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.529 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -147.65 -171.31 3.78 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.196 0.522 . . . . 0.0 111.536 -179.131 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.603 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.1 OUTLIER -135.85 147.5 28.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.157 -179.395 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . 0.421 ' HA3' ' HG2' ' B' ' 384' ' ' ARG . . . -35.34 -28.8 0.01 OUTLIER Glycine 0 C--N 1.332 0.311 0 CA-C-N 115.488 -0.778 . . . . 0.0 113.62 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . 0.463 ' N ' ' O ' ' B' ' 406' ' ' VAL . 59.3 m-20 -70.31 -3.17 15.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.877 0.37 . . . . 0.0 111.099 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 82.26 33.06 26.9 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.783 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.529 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 19.3 m -116.18 118.38 32.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.587 0.232 . . . . 0.0 111.375 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.465 ' HA ' ' HB3' ' B' ' 405' ' ' ARG . 70.9 t -92.32 111.9 25.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.156 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.535 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.5 OUTLIER -67.37 -36.21 80.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.364 -0.38 . . . . 0.0 109.978 179.164 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.445 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . -175.29 -152.57 9.45 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.518 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.45 HG23 ' O ' ' B' ' 402' ' ' VAL . 0.1 OUTLIER -159.92 174.17 14.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.475 0.179 . . . . 0.0 110.701 -179.84 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.463 ' CA ' ' HG2' ' B' ' 426' ' ' ARG . . . -169.03 128.51 1.7 Allowed Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.133 -1.032 . . . . 0.0 112.877 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.415 HG23 ' O ' ' B' ' 400' ' ' SER . 7.1 p -123.49 155.59 29.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.853 0.358 . . . . 0.0 110.411 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.587 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -164.43 169.22 39.13 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.554 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.519 ' N ' HD11 ' B' ' 422' ' ' ILE . 8.1 ptm180 -79.98 -39.95 29.0 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 117.312 0.556 . . . . 0.0 111.532 -179.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.635 ' O ' ' N ' ' B' ' 421' ' ' LYS . 3.0 p-10 -101.99 31.75 3.77 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.566 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.79 -46.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.635 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -44.42 -55.17 5.23 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 118.796 0.725 . . . . 0.0 109.806 -179.474 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.579 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -42.83 -34.26 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.571 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.194 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.566 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -68.61 -44.81 73.48 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.184 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -60.03 -62.98 5.47 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.181 -1.009 . . . . 0.0 111.676 179.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . . . . . . . . . 4.4 mp -56.73 -42.24 76.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.91 0.386 . . . . 0.0 110.393 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.579 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -56.02 -43.57 77.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.126 179.434 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.476 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -56.41 -50.51 71.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.337 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.543 ' HB1' ' CB ' ' B' ' 370' ' ' ALA . . . -55.08 -59.65 4.46 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.665 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.459 ' O ' ' HB3' ' B' ' 433' ' ' ARG . 2.9 mt-10 -50.07 -29.87 9.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.124 0.488 . . . . 0.0 109.838 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.514 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 0.8 OUTLIER -67.79 -38.12 82.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.398 179.5 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.478 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -62.69 -41.79 99.29 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.165 0.507 . . . . 0.0 110.204 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.522 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.1 OUTLIER -87.26 5.94 35.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.362 179.124 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . 0.514 ' CG ' ' O ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -89.4 11.81 18.14 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.109 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.544 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 14.4 m-20 -125.81 81.38 1.98 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.521 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 12.3 ptpt -46.93 -49.35 20.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.427 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.521 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.2 mmmm -61.22 -46.12 91.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.742 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.544 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 18.9 tmm? -63.24 -45.92 89.31 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.003 0.43 . . . . 0.0 110.076 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.485 HD22 ' CG1' ' B' ' 378' ' ' ILE . 84.3 mt -57.37 -62.42 1.78 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.915 179.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -54.03 -32.28 53.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.014 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.476 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.7 OUTLIER -57.86 -43.3 85.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.118 179.661 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -73.81 -28.31 61.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.568 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.57 -51.37 67.34 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 11.0 ttpp -63.31 -48.14 79.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.577 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.446 ' O ' HG12 ' B' ' 448' ' ' ILE . 3.6 mt-30 -50.11 -44.93 52.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.81 179.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.529 ' O ' ' CG1' ' B' ' 448' ' ' ILE . 0.0 OUTLIER -55.84 -47.07 77.9 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.361 179.506 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -61.96 -42.01 98.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.543 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.531 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -72.58 -78.0 0.09 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.963 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.531 ' C ' ' O ' ' B' ' 447' ' ' ALA . 1.4 pt -0.39 103.9 0.02 OUTLIER Pre-proline 0 N--CA 1.467 0.389 0 O-C-N 124.066 0.854 . . . . 0.0 112.758 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . 0.528 ' CG ' ' OXT' ' B' ' 453' ' ' SER . 77.9 Cg_endo -83.83 71.62 5.72 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 123.036 2.491 . . . . 0.0 112.756 -179.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . 0.497 ' HG2' ' O ' ' B' ' 449' ' ' PRO . 0.0 OUTLIER 50.94 30.56 5.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.625 179.683 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -176.57 -177.36 0.81 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.884 0.373 . . . . 0.0 111.085 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.13 -66.28 0.42 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.885 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 453' ' ' SER . . . . . 0.528 ' OXT' ' CG ' ' B' ' 449' ' ' PRO . 57.9 p . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.898 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.748 " O2'" ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.735 0 O4'-C1'-N19 111.427 3.227 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.748 ' H8 ' " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.082 0 O4'-C1'-N19 111.093 2.893 . 0.116 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.476 ' C5 ' ' C6 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.41 0 C5'-C4'-C3' 111.17 -2.886 . 0.13 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.467 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.171 0 O4'-C1'-N19 111.238 3.038 . 0.124 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.662 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.147 0 O4'-C1'-N19 111.103 2.903 . 0.167 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.439 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.288 0 C5'-C4'-C3' 111.317 -2.789 . 0.326 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.7 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.003 0 O4'-C1'-N19 111.541 3.341 . 0.276 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.452 ' C6 ' " H2'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.312 0 O4'-C1'-N19 110.941 2.741 . 0.237 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.439 2.045 0 O4'-C1'-N19 111.111 2.911 . 0.454 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.5 " O2'" " C5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -2.024 0 C5'-C4'-C3' 111.071 -2.953 . 0.199 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.6 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.517 0 C5'-C4'-C3' 111.211 -2.859 . 0.024 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.667 ' H6 ' " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.432 -1.757 0 C5'-C4'-C3' 110.862 -3.092 . 0.074 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.668 " O2'" " C5'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.444 0 C3'-C2'-C1' 104.833 3.704 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.713 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.282 0 C5'-C4'-C3' 110.893 -3.071 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.713 " O4'" " H2'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.935 0 C5'-C4'-C3' 111.002 -2.999 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.861 " H4'" " O5'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -1.996 0 O4'-C1'-N19 111.306 3.106 OUTLIER-EPSILON 0.01 1b . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.861 " O5'" " H4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.432 -1.766 0 C5'-C4'-C3' 110.999 -3.0 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.672 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.658 0 O4'-C1'-N19 110.982 2.782 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.661 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.097 0 C5'-C4'-C3' 111.162 -2.892 . 0.044 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.848 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.434 1.673 0 C5'-C4'-C3' 110.982 -3.012 . 0.215 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.848 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.349 0 C5'-C4'-C3' 111.05 -2.967 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.814 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.9 0 C5'-C4'-C3' 111.175 -2.883 . 0.03 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.746 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.257 0 O4'-C1'-N19 111.218 3.018 . 0.051 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.626 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.298 0 O4'-C1'-N19 111.442 3.242 . 0.389 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.533 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.242 0 O4'-C1'-N19 110.982 2.782 . 0.18 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.533 ' C6 ' ' C6 ' ' A' ' 25' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.531 0 O4'-C1'-N19 111.122 2.922 . 0.119 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.477 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.111 0 O4'-C1'-N19 111.235 3.035 . 0.131 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.581 " O2'" " O5'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.382 0 C3'-C2'-C1' 104.338 3.153 . 0.094 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.996 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.357 0 O4'-C1'-N19 111.294 3.094 . 0.174 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.996 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.161 0 O4'-C1'-N19 111.302 3.102 . 0.282 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.896 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.528 0 O4'-C1'-N19 111.288 3.088 . 0.303 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.576 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.261 0 C5'-C4'-C3' 111.158 -2.894 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . 0.404 ' O ' ' CG ' ' B' ' 429' ' ' GLU . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.527 -0.229 . . . . 0.0 112.527 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.81 51.04 1.94 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.842 0.353 . . . . 0.0 110.879 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.19 130.83 35.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.816 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.7 OUTLIER -53.83 -69.63 0.12 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.495 179.655 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.47 ' O ' ' HB2' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -40.76 -42.67 1.82 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.587 179.662 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -63.84 -36.92 85.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.521 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.51 ' N ' ' O ' ' B' ' 367' ' ' ASP . . . -68.54 -74.26 0.13 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.605 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.434 ' C ' ' O ' ' B' ' 370' ' ' ALA . 0.1 OUTLIER -37.11 -44.08 0.53 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.076 0.465 . . . . 0.0 110.274 179.67 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.554 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.6 OUTLIER -64.31 -42.65 96.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.764 179.695 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.513 ' HG3' ' HB2' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -57.34 -42.83 82.72 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.174 0.512 . . . . 0.0 110.563 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.439 ' CD2' HD13 ' B' ' 432' ' ' LEU . 0.4 OUTLIER -64.69 -72.79 0.14 Allowed 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -178.62 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 4.6 m-30 -79.54 -25.02 41.78 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -177.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -91.08 -31.71 16.15 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.872 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.533 ' O ' ' CD1' ' B' ' 378' ' ' ILE . 4.6 mm? -110.85 -13.63 14.11 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.711 -0.396 . . . . 0.0 112.056 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.533 ' CD1' ' O ' ' B' ' 377' ' ' LEU . 12.5 mm -141.99 -121.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.678 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.516 ' C ' ' O ' ' B' ' 378' ' ' ILE . . . -13.9 82.2 0.0 OUTLIER Glycine 0 C--N 1.343 0.971 0 N-CA-C 114.13 0.412 . . . . 0.0 114.13 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.551 ' O ' ' CB ' ' B' ' 381' ' ' ALA . 0.6 OUTLIER -74.27 -58.97 2.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.764 0.316 . . . . 0.0 110.317 179.591 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.551 ' CB ' ' O ' ' B' ' 380' ' ' TYR . . . 155.28 34.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.481 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.98 16.95 0.67 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.657 0.265 . . . . 0.0 111.188 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.511 ' CD1' ' HB2' ' B' ' 385' ' ' LEU . 0.2 OUTLIER -123.87 26.16 7.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.975 0.417 . . . . 0.0 110.635 179.565 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.475 ' HG3' ' HA3' ' B' ' 407' ' ' GLY . 0.0 OUTLIER 36.79 41.28 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.15 179.858 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.588 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 1.1 tt -69.2 132.62 46.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.978 0.418 . . . . 0.0 110.752 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 -169.05 135.25 1.7 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.298 0.57 . . . . 0.0 112.194 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.558 ' OH ' ' CB ' ' B' ' 431' ' ' ALA . 2.3 m-85 -84.41 178.55 7.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.325 -0.852 . . . . 0.0 108.741 178.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.538 HG21 ' CB ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -153.6 108.57 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.297 0.57 . . . . 0.0 112.153 178.525 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 389' ' ' THR . . . . . 0.415 ' O ' HG21 ' B' ' 389' ' ' THR . 3.2 m -72.18 100.04 2.48 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.269 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.476 ' O ' HG21 ' B' ' 401' ' ' ILE . 32.6 m -107.96 148.66 11.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.234 0.54 . . . . 0.0 111.116 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.464 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 15.1 tptt 80.82 55.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.406 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.443 ' C ' ' O ' ' B' ' 391' ' ' LYS . 3.0 mmpt? -33.88 131.33 0.4 Allowed Pre-proline 0 C--N 1.332 -0.152 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.555 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.548 ' HA ' ' O ' ' B' ' 398' ' ' PRO . 52.2 Cg_exo -53.74 174.42 0.15 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.554 2.169 . . . . 0.0 112.912 -178.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.527 ' OG1' ' N ' ' B' ' 397' ' ' ASP . 3.8 p -140.99 151.4 44.11 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.512 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -76.76 -5.37 47.86 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.137 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.513 HG11 HO2' ' A' ' 30' ' ' ' C' . 35.7 m -125.39 9.46 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.485 0.659 . . . . 0.0 110.073 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.527 ' N ' ' OG1' ' B' ' 394' ' ' THR . 7.5 m-20 179.18 63.19 0.11 Allowed Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 114.918 -1.037 . . . . 0.0 109.687 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.548 ' O ' ' HA ' ' B' ' 393' ' ' PRO . 39.7 Cg_exo -31.27 -65.99 0.08 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.333 2.689 . . . . 0.0 112.618 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.512 ' C ' ' O ' ' B' ' 398' ' ' PRO . 14.3 m120 7.71 116.6 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 400' ' ' SER . . . . . 0.465 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 0.3 OUTLIER -134.14 149.74 51.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.577 178.503 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.528 ' HA ' ' O ' ' B' ' 415' ' ' GLY . 1.3 tp -127.36 130.09 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 121.324 0.583 . . . . 0.0 112.478 -178.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.475 HG22 ' O ' ' B' ' 423' ' ' ALA . 0.7 OUTLIER -91.47 161.44 2.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.182 179.501 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.538 ' CB ' HG21 ' B' ' 388' ' ' VAL . 0.8 OUTLIER -138.58 96.83 3.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.97 0.414 . . . . 0.0 111.239 179.348 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.484 ' O ' HG13 ' B' ' 411' ' ' VAL . 0.0 OUTLIER -77.83 112.68 14.95 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.69 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.4 ' HA ' ' O ' ' B' ' 410' ' ' THR . 35.9 ttp180 -147.05 161.84 40.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.138 0.494 . . . . 0.0 111.551 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.588 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -130.56 128.8 63.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.149 -179.184 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . 0.475 ' HA3' ' HG3' ' B' ' 384' ' ' ARG . . . -30.03 -34.48 0.01 OUTLIER Glycine 0 C--N 1.334 0.442 0 C-N-CA 121.284 -0.484 . . . . 0.0 113.686 -179.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . 0.514 ' N ' ' O ' ' B' ' 406' ' ' VAL . 6.5 m-20 -55.19 -18.51 6.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.059 0.457 . . . . 0.0 110.386 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 99.35 32.35 5.81 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.834 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.518 HG22 ' CD1' ' B' ' 412' ' ' LEU . 40.0 m -122.19 121.38 36.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.964 0.412 . . . . 0.0 111.53 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.484 HG13 ' O ' ' B' ' 404' ' ' CYS . 38.6 t -90.29 84.67 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.439 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.518 ' CD1' HG22 ' B' ' 410' ' ' THR . 0.1 OUTLIER -43.06 -23.32 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.34 -179.598 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.424 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 161.61 -174.01 38.07 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.013 -1.089 . . . . 0.0 113.044 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.46 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -143.08 171.73 13.67 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.528 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -160.7 144.06 9.58 Favored Glycine 0 C--O 1.221 -0.692 0 C-N-CA 119.779 -1.2 . . . . 0.0 113.16 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.464 ' HB ' HD12 ' B' ' 401' ' ' ILE . 5.0 p -132.86 155.01 40.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.487 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -170.3 151.65 17.03 Favored Glycine 0 N--CA 1.453 -0.187 0 C-N-CA 120.02 -1.086 . . . . 0.0 113.293 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.486 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 2.3 mtm-85 -70.51 -55.26 9.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.907 0.384 . . . . 0.0 110.499 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.607 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.2 OUTLIER -75.63 -21.65 57.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.888 179.217 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.607 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 98.14 -41.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.113 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.144 -179.291 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.596 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -52.95 -40.41 63.64 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.579 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.598 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -59.14 -35.92 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.748 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 177.355 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.513 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -68.73 -36.65 78.68 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.016 178.14 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.76 -67.14 2.15 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.952 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . . . . . . . . . 2.4 mp -53.81 -48.3 61.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 178.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.598 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -50.08 -49.57 51.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.178 179.402 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . . . . . . . . . . . -49.68 -44.63 48.01 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.52 ' O ' ' N ' ' B' ' 431' ' ' ALA . . . -57.35 -68.07 0.27 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.552 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.511 ' HA ' HD12 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -43.6 -25.6 0.18 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.668 179.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.43 ' CG ' ' O ' ' B' ' 414' ' ' THR . 11.3 m-80 -79.6 -32.88 41.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.712 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.558 ' CB ' ' OH ' ' B' ' 387' ' ' TYR . . . -65.52 -40.99 93.6 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 120.87 0.367 . . . . 0.0 110.517 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.538 ' O ' ' CD1' ' B' ' 438' ' ' LEU . 0.0 OUTLIER -95.85 25.86 4.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.479 0.657 . . . . 0.0 109.905 179.032 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -96.38 -8.83 31.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.087 179.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -101.16 96.68 7.37 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.788 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.523 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 4.4 ptpp? -51.78 -51.11 58.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.259 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.523 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 8.6 mmtt -56.25 -50.12 72.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.98 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.467 ' SD ' ' CD1' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -66.61 -43.49 84.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.93 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.538 ' CD1' ' O ' ' B' ' 432' ' ' LEU . 35.8 mt -61.72 -55.73 27.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.22 0.534 . . . . 0.0 111.103 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . 0.479 ' O ' ' HG3' ' B' ' 443' ' ' LYS . 20.2 t70 -65.39 -27.35 68.49 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.169 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -59.79 -47.43 85.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.949 -0.568 . . . . 0.0 109.994 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.468 ' CD1' HD23 ' B' ' 383' ' ' LEU . 60.8 m-85 -75.02 -35.43 61.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.592 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -48.57 -51.85 25.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.947 0.403 . . . . 0.0 110.075 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . 0.479 ' HG3' ' O ' ' B' ' 439' ' ' ASP . 0.0 OUTLIER -72.65 -46.93 51.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.873 179.035 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.459 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -53.69 -19.18 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.697 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.551 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.2 OUTLIER -87.52 -57.06 3.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.808 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -54.24 -22.25 11.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.122 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . -81.39 -59.47 2.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.11 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.491 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 6.1 pt -39.01 133.03 1.12 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.259 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . 0.462 ' O ' ' O ' ' B' ' 448' ' ' ILE . 73.5 Cg_exo -50.06 -164.44 0.0 OUTLIER 'Trans proline' 0 C--O 1.231 0.136 0 C-N-CA 122.965 2.443 . . . . 0.0 112.515 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -100.84 -58.8 1.82 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.047 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 5.4 m -120.8 169.91 9.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.082 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -73.88 149.17 41.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.565 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 87.2 p . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.92 -179.679 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.629 " O2'" ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.827 0 O4'-C1'-N19 111.438 3.238 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.847 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.071 0 O4'-C1'-N19 111.156 2.956 . 0.367 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.847 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.462 0 C5'-C4'-C3' 111.249 -2.834 . 0.13 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.551 HO2' " C5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.252 0 O4'-C1'-N19 111.337 3.137 . 0.119 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.662 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 1.973 0 C5'-C4'-C3' 111.224 -2.85 . 0.028 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.443 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.346 0 C5'-C4'-C3' 111.18 -2.88 . 0.165 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.755 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 P--O5' 1.611 1.802 0 C5'-C4'-C3' 110.994 -3.004 . 0.133 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.699 ' N4 ' ' N4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.648 0 C3'-C2'-C1' 104.827 3.697 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.675 ' P ' HO2' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.1 0 O4'-C1'-N19 111.035 2.835 . 0.019 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.593 " O2'" " C5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.356 0 C5'-C4'-C3' 111.12 -2.92 . 0.057 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.649 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.359 0 O4'-C1'-N19 111.138 2.938 . 0.046 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.696 ' H6 ' " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.932 0 C5'-C4'-C3' 110.856 -3.096 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.741 " O2'" " H5'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.181 0 O4'-C1'-N19 111.515 3.315 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.741 " H5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.206 0 C5'-C4'-C3' 111.355 -2.763 . 0.452 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.629 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.906 0 C5'-C4'-C3' 110.806 -3.129 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.629 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.848 0 O4'-C1'-N19 111.61 3.41 . 0.28 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.561 " O2'" ' N9 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.776 0 C5'-C4'-C3' 110.942 -3.038 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.561 ' N9 ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.728 0 C5'-C4'-C3' 110.866 -3.09 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.445 " O4'" " C2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.095 0 C5'-C4'-C3' 111.083 -2.944 . 0.295 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.828 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 P--O5' 1.609 1.632 0 C5'-C4'-C3' 110.95 -3.033 . 0.179 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.828 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.443 0 C3'-C2'-C1' 104.447 3.275 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.851 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.612 1.916 0 O4'-C1'-N19 111.269 3.069 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.672 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.183 0 O4'-C1'-N19 111.815 3.615 . 0.026 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.644 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.236 0 O4'-C1'-N19 110.989 2.789 . 0.127 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.578 " H5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.273 0 O4'-C1'-N19 111.35 3.15 . 0.237 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.538 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.548 0 C5'-C4'-C3' 111.314 -2.791 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.604 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.161 0 O4'-C1'-N19 111.083 2.883 . 0.156 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.604 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.047 0 O4'-C1'-N19 111.408 3.208 . 0.434 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.74 " H2'" " O4'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.238 0 C5'-C4'-C3' 111.413 -2.725 . 0.075 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 1.017 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.21 0 O4'-C1'-N19 111.39 3.19 . 0.395 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 1.017 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.574 0 C3'-C2'-C1' 104.14 2.933 . 0.164 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.556 " O4'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.437 0 O4'-C1'-N19 111.134 2.934 . 0.341 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' B' ' 365' ' ' SER . . . . . . . . 0 N--CA 1.489 2.183 0 N-CA-C 112.59 -0.204 . . . . 0.0 112.59 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 365' ' ' SER . . . . . 0.401 ' C ' ' O ' ' B' ' 364' ' ' GLY . 87.9 p 36.67 56.93 1.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.863 0.363 . . . . 0.0 111.213 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.433 HD22 ' SD ' ' B' ' 368' ' ' MET . 1.8 tp -132.42 126.6 33.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.864 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.9 OUTLIER -54.01 -68.77 0.15 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.888 0.375 . . . . 0.0 110.12 179.573 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.501 ' HA ' ' HD2' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -34.59 -45.56 0.25 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.429 179.772 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.401 ' HB2' ' O ' ' B' ' 366' ' ' LEU . 93.9 m-20 -59.39 -48.01 83.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.509 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.534 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -62.33 -75.28 0.08 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.581 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.501 ' HD2' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -31.58 -41.92 0.05 OUTLIER 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.105 -179.673 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.58 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.4 OUTLIER -65.44 -45.59 83.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.346 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.534 ' HG3' ' CB ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -58.91 -39.58 81.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.177 0.513 . . . . 0.0 111.153 -179.792 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.482 HD11 ' CB ' ' B' ' 431' ' ' ALA . 1.3 mm? -67.66 -71.09 0.22 Allowed 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.487 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-30 -87.37 5.88 36.45 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -177.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.58 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -122.56 -20.35 6.04 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.103 179.321 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 0.8 OUTLIER -116.15 -27.42 6.9 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.453 179.75 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.522 HG13 ' CD2' ' B' ' 438' ' ' LEU . 3.7 mm -142.07 33.58 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.112 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.487 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -122.28 86.27 0.39 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.72 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.53 ' CD2' ' HD3' ' B' ' 445' ' ' ARG . 5.1 p90 -97.86 167.63 10.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.726 0.298 . . . . 0.0 110.491 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.55 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -66.9 114.86 6.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.916 0.389 . . . . 0.0 111.714 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.55 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.4 p 90.42 44.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.881 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.507 ' CD1' ' O ' ' B' ' 378' ' ' ILE . 1.0 OUTLIER -92.61 -40.41 10.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.939 0.4 . . . . 0.0 110.684 179.657 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.446 ' CB ' ' O ' ' B' ' 383' ' ' LEU . 2.0 tpt180 81.78 -8.95 1.28 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.106 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.582 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 7.9 tt -40.83 136.02 1.53 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.493 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -164.11 148.85 10.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.541 0.686 . . . . 0.0 112.577 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.496 ' HA ' ' O ' ' B' ' 403' ' ' GLU . 2.8 m-85 -101.23 141.95 33.37 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.989 179.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.489 HG21 ' HB2' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -121.25 120.02 60.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.16 0.505 . . . . 0.0 111.324 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 10.6 m -76.27 134.38 39.8 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.77 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.527 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 20.8 m -141.14 157.78 22.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.874 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.527 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 4.5 tmtt? 85.99 62.6 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.21 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.461 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER -29.47 125.92 0.26 Allowed Pre-proline 0 C--N 1.334 -0.075 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.001 -179.492 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.485 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 8.1 Cg_exo -70.39 161.16 47.02 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.559 2.173 . . . . 0.0 113.023 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.46 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 1.6 p -135.78 165.49 25.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.92 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . 0.498 ' O ' " O2'" ' A' ' 30' ' ' ' C' . . . -90.97 19.86 5.32 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.361 0.6 . . . . 0.0 110.478 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 14.5 m -139.78 14.19 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.329 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.464 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 4.6 m-20 163.82 54.63 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.839 -179.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.486 ' HB3' " O4'" ' A' ' 5' ' ' ' U' . 5.2 Cg_exo -40.15 -25.56 0.17 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.509 2.806 . . . . 0.0 112.818 -179.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.566 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 52.5 p30 -30.99 148.41 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.328 0.585 . . . . 0.0 112.082 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -155.26 155.85 34.53 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.281 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.587 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -108.49 152.8 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.448 179.707 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.587 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.2 OUTLIER -123.48 142.69 39.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.736 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.496 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 1.8 mt-10 -108.29 128.4 54.71 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 179.161 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.545 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.8 OUTLIER -108.09 109.57 21.04 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.099 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.514 ' CB ' ' HA ' ' B' ' 411' ' ' VAL . 0.0 OUTLIER -145.59 -156.68 0.73 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.181 0.515 . . . . 0.0 111.704 -178.894 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.582 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -151.86 143.34 15.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.271 -179.443 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -38.23 -27.56 0.04 OUTLIER Glycine 0 C--N 1.332 0.353 0 CA-C-N 115.612 -0.722 . . . . 0.0 113.361 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . 0.42 ' C ' ' OD1' ' B' ' 408' ' ' ASP . 47.0 p30 -69.51 -4.71 20.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.812 0.339 . . . . 0.0 110.878 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 85.04 39.33 8.61 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.156 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.502 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 12.8 m -127.31 118.29 23.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.724 0.297 . . . . 0.0 111.659 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.514 ' HA ' ' CB ' ' B' ' 405' ' ' ARG . 52.1 t -92.96 112.1 25.67 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.807 179.364 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.545 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.5 OUTLIER -67.24 -37.64 83.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.383 179.418 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.46 ' O ' ' HB ' ' B' ' 414' ' ' THR . . . -174.35 -150.66 7.82 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.505 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.471 ' OG1' ' O ' ' B' ' 402' ' ' VAL . 13.2 t 176.09 155.3 0.21 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.694 0.283 . . . . 0.0 111.028 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.475 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -150.52 -177.18 24.2 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.461 -0.876 . . . . 0.0 112.796 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 2.2 p -153.16 161.55 2.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.796 0.331 . . . . 0.0 110.926 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.566 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -166.21 171.63 41.31 Favored Glycine 0 C--O 1.225 -0.454 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.933 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.531 ' N ' HD12 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -83.64 -39.92 19.64 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 117.067 0.434 . . . . 0.0 111.362 -179.857 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.631 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.2 OUTLIER -104.44 31.81 4.43 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.048 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.537 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.33 -45.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 178.875 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.631 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -45.9 -49.35 15.67 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.296 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.602 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -47.49 -40.62 7.08 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.62 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.935 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.537 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -65.77 -40.42 91.99 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.485 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.92 -67.91 1.89 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.552 -0.832 . . . . 0.0 111.227 178.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.515 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 1.1 mp -52.52 -47.27 48.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.602 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 11.4 tpt180 -51.37 -47.95 62.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.72 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.487 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -47.36 -49.52 24.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.46 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.517 ' HB2' ' CB ' ' B' ' 370' ' ' ALA . . . -56.34 -57.66 11.31 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.511 ' HA ' HD22 ' B' ' 432' ' ' LEU . 0.5 OUTLIER -49.36 -20.05 0.61 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.712 179.257 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.487 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 4.3 m-80 -83.86 -36.91 23.08 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.916 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.482 ' CB ' HD11 ' B' ' 374' ' ' LEU . . . -65.42 -40.69 93.65 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.857 0.36 . . . . 0.0 111.167 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.534 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.0 OUTLIER -89.57 9.41 26.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.98 179.89 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . 0.528 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 23.8 ttm180 -89.97 3.74 52.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.077 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.435 ' HB3' ' CB ' ' B' ' 437' ' ' MET . 48.3 m-20 -115.09 87.34 2.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.896 0.379 . . . . 0.0 111.116 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.531 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -50.19 -51.23 45.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.987 179.506 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.531 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -57.94 -43.84 86.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.602 179.61 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.523 ' CE ' ' HG ' ' B' ' 412' ' ' LEU . 9.2 tmm? -66.48 -49.67 65.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.134 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.522 ' CD2' HG13 ' B' ' 378' ' ' ILE . 47.4 mt -54.91 -63.31 1.19 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.042 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -56.22 -31.1 63.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.938 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.464 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.3 OUTLIER -59.22 -38.95 81.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.105 179.723 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.442 ' O ' ' HB2' ' B' ' 445' ' ' ARG . 43.3 m-85 -82.62 -21.09 35.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.782 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -67.47 -52.48 38.77 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -61.69 -45.0 95.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.502 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.523 ' O ' ' CG2' ' B' ' 448' ' ' ILE . 0.5 OUTLIER -59.63 -52.96 63.28 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.941 179.003 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.53 ' HD3' ' CD2' ' B' ' 380' ' ' TYR . 0.1 OUTLIER -40.47 -51.4 2.88 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.718 179.168 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -72.52 -31.58 65.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.15 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.503 ' O ' ' HD3' ' B' ' 449' ' ' PRO . . . -117.06 57.11 0.8 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.552 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.523 ' CG2' ' O ' ' B' ' 444' ' ' GLN . 17.3 pt -102.18 102.87 26.86 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-O 121.117 0.484 . . . . 0.0 111.243 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . 0.503 ' HD3' ' O ' ' B' ' 447' ' ' ALA . 31.7 Cg_exo -59.51 -146.55 0.01 OUTLIER 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 123.097 2.531 . . . . 0.0 112.603 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 27.1 ptt85 -54.76 -169.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.167 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -157.02 128.98 7.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.609 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -150.9 131.07 13.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.936 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 59.3 p . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.856 179.979 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 1.009 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.633 0 O4'-C1'-N19 111.207 3.007 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 1.009 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.229 0 O4'-C1'-N19 111.327 3.127 . 0.099 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.593 HO2' ' P ' ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.638 0 C3'-C2'-C1' 105.057 3.953 OUTLIER-DELTA 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.593 ' P ' HO2' ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.31 0 C5'-C4'-C3' 111.225 -2.85 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.597 " O2'" " H5'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.134 0 O4'-C1'-N19 111.155 2.955 . 0.122 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.597 " H5'" " O2'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.358 0 C5'-C4'-C3' 111.155 -2.897 . 0.162 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.583 " C5'" " O2'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.946 0 O4'-C1'-N19 111.331 3.131 . 0.042 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.437 ' C6 ' " H2'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 P--O5' 1.614 2.086 0 O4'-C1'-N19 110.888 2.688 . 0.111 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.737 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.486 0 C5'-C4'-C3' 111.278 -2.815 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.737 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.744 0 C3'-C2'-C1' 104.615 3.461 . 0.073 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.665 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 O4'-C1'-N19 111.096 2.896 . 0.038 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.721 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.797 0 C5'-C4'-C3' 111.048 -2.968 . 0.031 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.721 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 O4'-C1'-N19 111.433 3.233 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.661 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.114 0 O4'-C1'-N19 111.184 2.984 . 0.221 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.866 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.909 0 C5'-C4'-C3' 111.133 -2.912 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.866 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.609 1.624 0 O4'-C1'-N19 111.789 3.589 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.746 ' OP2' " H4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -1.966 0 C5'-C4'-C3' 110.677 -3.216 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.699 ' P ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.716 0 C5'-C4'-C3' 111.213 -2.858 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.604 " O2'" " C5'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 1.978 0 C5'-C4'-C3' 111.125 -2.917 . 0.05 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.836 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.865 0 C5'-C4'-C3' 111.004 -2.997 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.836 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.287 0 C5'-C4'-C3' 111.074 -2.951 . 0.047 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.874 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.867 0 O4'-C1'-N19 111.218 3.018 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.716 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.177 0 O4'-C1'-N19 111.076 2.876 . 0.019 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.66 ' C4 ' ' C6 ' ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.641 0 C3'-C2'-C1' 104.883 3.759 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.564 " O5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.271 0 O4'-C1'-N19 111.276 3.076 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.577 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.508 0 O4'-C1'-N19 111.339 3.139 . 0.145 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.918 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.072 0 O4'-C1'-N19 111.027 2.827 . 0.104 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.918 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.591 1 C3'-C2'-C1' 105.199 4.11 OUTLIER-DELTA 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.94 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.021 0 O4'-C1'-N19 111.063 2.863 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.94 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.376 0 O4'-C1'-N19 111.65 3.45 . 0.343 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.682 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.772 0 C3'-C2'-C1' 104.335 3.15 . 0.076 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.638 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.588 0 C5'-C4'-C3' 111.129 -2.914 . 0.452 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.14 0 N-CA-C 112.543 -0.223 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 53.72 24.61 4.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.773 0.32 . . . . 0.0 111.047 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.476 ' N ' ' OE2' ' B' ' 429' ' ' GLU . 0.2 OUTLIER -117.95 114.32 23.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.065 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.549 ' O ' ' N ' ' B' ' 370' ' ' ALA . 7.3 t0 -56.57 -67.88 0.27 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.464 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.443 ' C ' ' O ' ' B' ' 367' ' ' ASP . 0.9 OUTLIER -33.49 -52.57 0.39 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.72 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.43 ' ND2' ' CD2' ' B' ' 366' ' ' LEU . 66.2 m-20 -60.0 -42.73 94.88 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.401 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.549 ' N ' ' O ' ' B' ' 367' ' ' ASP . . . -61.35 -78.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.796 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.488 ' HB3' HO2' ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -32.03 -44.75 0.09 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.834 -179.606 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.511 ' O ' ' HB2' ' B' ' 376' ' ' SER . 0.0 OUTLIER -58.62 -58.93 6.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.355 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.564 ' HG3' ' CB ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -47.28 -56.13 7.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.331 0.586 . . . . 0.0 110.974 179.814 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.478 ' N ' ' CD2' ' B' ' 374' ' ' LEU . 2.0 mt -46.39 -69.76 0.12 Allowed 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -178.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -89.77 -45.16 9.48 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -176.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.511 ' HB2' ' O ' ' B' ' 372' ' ' ARG . 49.6 m -67.48 -20.78 65.51 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.753 -179.071 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.543 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 2.1 tp -110.82 -39.25 4.89 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 120.639 0.257 . . . . 0.0 110.836 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.432 HD11 HG21 ' B' ' 378' ' ' ILE . 1.9 mm -126.91 -151.42 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.408 ' H ' ' CG2' ' B' ' 378' ' ' ILE . . . 40.81 64.85 1.14 Allowed Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.532 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.594 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 4.2 p90 -81.36 -61.74 1.86 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.558 0.179 . . . . 0.0 111.307 -179.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.53 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . 160.15 71.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 8.7 t 156.21 21.89 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.48 ' O ' ' HB3' ' B' ' 384' ' ' ARG . 0.8 OUTLIER -117.4 -26.39 6.7 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 122.063 -0.398 . . . . 0.0 110.949 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.48 ' HB3' ' O ' ' B' ' 383' ' ' LEU . 8.7 tpp180 79.59 48.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.552 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.579 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 5.2 tt -84.25 132.57 34.63 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 13.1 p-80 -164.94 147.8 8.36 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.527 ' CZ ' ' SG ' ' B' ' 404' ' ' CYS . 7.4 m-85 -103.26 144.92 30.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.133 178.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.432 HG23 ' HB2' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -123.97 125.17 70.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.167 0.508 . . . . 0.0 110.799 179.229 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.4 m -83.92 126.18 32.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.964 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.516 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 27.2 m -134.39 155.32 38.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.812 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.516 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 11.6 tptp 86.82 57.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.599 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER -33.87 122.02 0.49 Allowed Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.515 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.452 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 17.1 Cg_exo -63.14 162.33 26.76 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.608 2.205 . . . . 0.0 112.701 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.432 ' OG1' HG22 ' B' ' 396' ' ' VAL . 2.9 p -134.49 170.14 16.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.888 -179.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . 0.522 ' HB1' ' O2 ' ' A' ' 29' ' ' ' U' . . . -93.47 16.93 12.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.833 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.432 HG22 ' OG1' ' B' ' 394' ' ' THR . 29.5 m -135.9 11.8 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.441 178.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.433 ' O ' ' N ' ' B' ' 399' ' ' ASN . 1.1 m-20 163.78 64.84 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.218 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.553 ' HB3' " C4'" ' A' ' 5' ' ' ' U' . 4.7 Cg_exo -37.05 -28.88 0.08 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 123.557 2.838 . . . . 0.0 112.363 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.486 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 8.3 m120 -21.91 121.88 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.483 -0.781 . . . . 0.0 112.347 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 400' ' ' SER . . . . . 0.444 ' O ' HG22 ' B' ' 416' ' ' VAL . 5.9 t -143.22 154.5 43.91 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.795 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.427 HG13 ' C ' ' B' ' 415' ' ' GLY . 16.8 tt -120.26 159.08 21.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.343 0.592 . . . . 0.0 111.381 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.485 ' CG2' ' C ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -121.08 152.61 24.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.276 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.432 ' HB2' HG23 ' B' ' 388' ' ' VAL . 32.3 mt-10 -122.12 125.31 45.9 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.981 0.42 . . . . 0.0 110.107 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.55 ' O ' ' N ' ' B' ' 412' ' ' LEU . 48.3 t -110.4 111.84 23.38 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.512 ' CB ' ' HA ' ' B' ' 411' ' ' VAL . 15.3 ptp180 -145.85 -175.86 4.91 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.232 0.539 . . . . 0.0 111.651 -179.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.579 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -146.68 144.96 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.134 -179.388 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . 0.481 ' O ' ' HB3' ' B' ' 408' ' ' ASP . . . 66.54 6.24 34.03 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.265 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . 0.481 ' HB3' ' O ' ' B' ' 407' ' ' GLY . 59.8 t0 74.85 39.66 0.4 Allowed 'General case' 0 C--O 1.23 0.078 0 CA-C-O 120.639 0.257 . . . . 0.0 111.536 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -167.12 -50.66 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.303 -0.951 . . . . 0.0 113.054 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.487 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 17.6 m -72.97 94.98 1.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.598 0.237 . . . . 0.0 111.2 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.512 ' HA ' ' CB ' ' B' ' 405' ' ' ARG . 95.4 t -82.82 111.46 19.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.786 0.327 . . . . 0.0 111.294 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.55 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.7 OUTLIER -65.44 -32.84 74.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.368 179.149 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 178.55 -158.25 22.63 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.608 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.444 HG23 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -156.19 167.67 29.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.791 0.329 . . . . 0.0 111.146 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.512 ' HA2' ' CG ' ' B' ' 426' ' ' ARG . . . -159.42 124.59 1.37 Allowed Glycine 0 C--O 1.225 -0.464 0 C-N-CA 120.531 -0.843 . . . . 0.0 112.572 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.444 HG22 ' O ' ' B' ' 400' ' ' SER . 10.1 p -124.33 151.88 29.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.778 0.323 . . . . 0.0 110.842 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.551 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -167.03 159.49 32.89 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.212 -0.994 . . . . 0.0 113.284 -179.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.535 ' N ' HD11 ' B' ' 422' ' ' ILE . 0.4 OUTLIER -67.18 -45.68 76.21 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.402 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.566 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.2 OUTLIER -98.68 30.17 3.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.215 0.531 . . . . 0.0 109.586 179.078 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.538 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 50.41 -44.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 115.227 1.566 . . . . 0.0 115.227 178.319 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.597 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -47.43 -48.93 26.24 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.595 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.597 ' N ' ' HD3' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -47.06 -37.23 3.84 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.628 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.169 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -69.02 -46.51 67.77 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.698 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.97 -59.34 10.95 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.429 -0.891 . . . . 0.0 111.424 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.51 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 1.2 mm -60.93 -40.15 84.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.804 0.335 . . . . 0.0 110.806 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.585 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 25.2 tpt180 -57.41 -42.09 81.6 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.376 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.476 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -62.12 -45.26 94.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.394 179.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.473 ' O ' HD21 ' B' ' 432' ' ' LEU . . . -56.16 -59.47 4.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.37 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.484 ' O ' ' HB2' ' B' ' 433' ' ' ARG . 1.0 OUTLIER -50.73 -31.46 16.71 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.127 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -63.86 -39.74 94.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.646 179.532 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.467 ' HB3' ' OH ' ' B' ' 387' ' ' TYR . . . -65.0 -41.62 95.21 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 120.993 0.425 . . . . 0.0 110.324 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.564 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -86.24 9.12 18.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.592 179.353 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . 0.484 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 2.3 ttm-85 -93.99 11.4 29.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.767 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.5 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 2.3 m-20 -125.39 79.81 1.84 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.805 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.505 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 10.4 ptpt -46.27 -48.9 17.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.016 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.505 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 3.3 mtpp -57.62 -46.62 83.9 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.817 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.5 ' HB3' ' HB2' ' B' ' 434' ' ' ASP . 1.5 tmm? -64.27 -65.12 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.049 0.452 . . . . 0.0 109.895 179.184 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.469 HD21 ' NE2' ' B' ' 373' ' ' GLN . 44.6 mt -39.13 -67.59 0.21 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.05 179.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -47.8 -43.95 28.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.69 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.467 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -52.64 -32.57 42.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.969 179.868 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' B' ' 438' ' ' LEU . 25.7 m-85 -75.57 -41.33 55.0 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.756 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' B' ' 445' ' ' ARG . . . -49.25 -43.9 43.26 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . 0.401 ' HD3' ' N ' ' B' ' 444' ' ' GLN . 0.1 OUTLIER -62.85 -50.45 70.86 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.769 178.512 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.5 ' O ' HG12 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -55.52 -36.57 66.87 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.775 179.064 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.594 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 5.0 mmm-85 -55.22 -52.9 61.89 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.489 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -58.4 -33.55 69.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.325 0.583 . . . . 0.0 109.465 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.466 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -84.18 -86.13 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.824 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.544 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 0.3 OUTLIER 27.14 89.01 0.07 OUTLIER Pre-proline 0 N--CA 1.465 0.279 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.516 -179.125 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -41.46 147.83 0.33 Allowed 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.876 2.384 . . . . 0.0 112.452 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -76.58 -29.2 56.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.396 -179.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 29.2 t -120.66 131.27 54.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 0.0 111.084 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -54.43 129.03 34.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.866 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 13.5 p . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.849 179.939 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.674 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 C2'--C1' 1.512 -1.565 0 C5'-C4'-C3' 111.088 -2.942 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.768 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.243 0 O4'-C1'-N19 111.114 2.914 . 0.039 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.768 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.517 0 C3'-C2'-C1' 104.839 3.711 . 0.044 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.628 " C5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.097 0 O4'-C1'-N19 111.372 3.172 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.431 " O5'" " O2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.362 0 O4'-C1'-N19 111.218 3.018 . 0.096 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.444 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.184 0 O4'-C1'-N19 111.128 2.928 . 0.194 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.882 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.876 0 O4'-C1'-N19 111.406 3.206 . 0.143 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.575 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.298 0 O4'-C1'-N19 111.088 2.888 . 0.228 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.575 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.508 0 C5'-C4'-C3' 111.257 -2.829 . 0.162 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.697 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.946 0 C5'-C4'-C3' 110.861 -3.093 . 0.093 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.621 HO2' " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.503 0 O4'-C1'-N19 110.977 2.777 . 0.033 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.943 ' H6 ' " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.818 0 C5'-C4'-C3' 111.037 -2.975 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.825 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.483 0 C3'-C2'-C1' 104.681 3.534 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.647 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.302 0 C5'-C4'-C3' 111.159 -2.894 . 0.149 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.742 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.251 0 C5'-C4'-C3' 111.099 -2.934 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.779 " H1'" ' OP2' ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.124 0 O4'-C1'-N19 111.551 3.351 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.779 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 P--O5' 1.611 1.821 0 C5'-C4'-C3' 110.839 -3.107 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.589 " H2'" " O4'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.436 1.835 0 C5'-C4'-C3' 111.023 -2.985 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.589 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.139 0 C5'-C4'-C3' 111.047 -2.968 . 0.04 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.728 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.723 0 C5'-C4'-C3' 110.898 -3.068 . 0.044 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.712 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.098 0 C5'-C4'-C3' 110.987 -3.009 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.852 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.962 0 O4'-C1'-N19 111.216 3.016 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.807 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.317 0 O4'-C1'-N19 111.762 3.562 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.704 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 P--O5' 1.616 2.261 0 O4'-C1'-N19 110.777 2.577 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.425 ' O6 ' ' O4 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.3 0 O4'-C1'-N19 111.295 3.095 . 0.327 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.662 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.328 0 O4'-C1'-N19 111.172 2.972 . 0.12 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.851 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.946 0 O4'-C1'-N19 111.141 2.941 . 0.257 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.851 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.414 0 C3'-C2'-C1' 104.514 3.349 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.929 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.273 0 O4'-C1'-N19 111.309 3.109 . 0.205 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.929 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.195 0 O4'-C1'-N19 111.613 3.413 . 0.166 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.817 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.268 0 O4'-C1'-N19 111.253 3.053 . 0.101 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.664 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.404 0 O4'-C1'-N19 111.101 2.901 . 0.501 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 N-CA-C 112.604 -0.198 . . . . 0.0 112.604 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 365' ' ' SER . . . . . 0.464 ' HB2' ' OD1' ' B' ' 367' ' ' ASP . 0.3 OUTLIER 49.18 83.16 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.836 0.351 . . . . 0.0 110.622 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.443 ' O ' ' C ' ' B' ' 367' ' ' ASP . 7.0 tp -57.9 -18.31 22.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.456 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.522 ' HB3' ' CD1' ' B' ' 425' ' ' ILE . 0.4 OUTLIER -38.72 -68.89 0.14 Allowed 'General case' 0 C--O 1.237 0.447 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.36 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.528 ' HE1' ' N ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -32.91 -56.09 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.112 178.93 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.528 ' N ' ' HE1' ' B' ' 368' ' ' MET . 2.7 m-20 -52.31 -56.1 17.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.376 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.566 ' CB ' ' CB ' ' B' ' 428' ' ' ALA . . . -43.4 -75.99 0.03 OUTLIER 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.574 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -35.78 -38.07 0.11 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.22 0.533 . . . . 0.0 110.36 179.849 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.545 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.1 tmt_? -59.6 -55.86 29.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.324 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.521 ' HG3' ' CB ' ' B' ' 432' ' ' LEU . 0.2 OUTLIER -50.4 -32.23 17.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.736 179.614 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.561 ' N ' ' CD2' ' B' ' 374' ' ' LEU . 0.1 OUTLIER -71.34 -78.41 0.08 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.714 -178.979 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.543 ' CD2' ' OP1' ' A' ' 20' ' ' ' A' . 3.5 m-30 -79.44 12.76 2.28 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -178.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -128.09 -28.46 2.62 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.705 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.464 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.4 OUTLIER -110.03 -16.9 13.71 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.758 -179.646 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.558 HG21 ' CD2' ' B' ' 441' ' ' TYR . 13.9 mm -132.35 -60.02 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 121.005 0.431 . . . . 0.0 110.041 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . . . . . . . . . . . -53.04 143.56 25.31 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.146 179.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.641 ' CE1' ' CZ ' ' B' ' 445' ' ' ARG . 0.5 OUTLIER -143.95 -48.94 0.29 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.557 -0.322 . . . . 0.0 111.537 179.82 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' B' ' 380' ' ' TYR . . . 171.76 -26.06 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.46 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.543 ' HB2' ' CE2' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -111.22 -6.51 14.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.808 0.337 . . . . 0.0 110.913 179.817 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.462 HD11 ' HB2' ' B' ' 385' ' ' LEU . 0.1 OUTLIER -48.18 -51.58 24.5 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.923 -179.968 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.448 ' HG2' ' HA3' ' B' ' 407' ' ' GLY . 2.3 tpt180 77.56 6.4 2.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.607 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.565 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 3.7 tt -49.54 135.28 18.51 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.793 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.417 ' O ' ' CD2' ' B' ' 386' ' ' HIS . 8.7 p-80 -153.35 134.46 14.06 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.365 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.574 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 6.9 m-85 -92.41 140.97 29.04 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.8 179.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -125.62 124.61 67.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.977 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 6.9 m -82.19 130.79 35.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.322 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.512 ' O ' HG22 ' B' ' 401' ' ' ILE . 21.6 m -135.25 160.07 40.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.279 0.562 . . . . 0.0 110.983 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.528 ' CB ' HG23 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 73.85 53.7 0.11 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.533 -179.623 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.476 ' C ' ' O ' ' B' ' 391' ' ' LYS . 3.7 mmtp -25.52 136.29 0.08 OUTLIER Pre-proline 0 N--CA 1.464 0.269 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.425 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -68.55 160.73 48.09 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.26 1.973 . . . . 0.0 112.59 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 1.5 p -127.59 158.79 36.55 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.835 -179.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . 0.506 ' O ' " O2'" ' A' ' 30' ' ' ' C' . . . -87.05 14.71 7.0 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.266 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.518 HG13 " O2'" ' A' ' 30' ' ' ' C' . 31.2 m -141.51 14.51 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.315 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 168.87 61.13 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 114.697 -1.138 . . . . 0.0 109.284 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.481 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 78.3 Cg_exo -41.8 -31.18 1.29 Allowed 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.329 2.686 . . . . 0.0 113.274 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.534 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.6 p-10 -28.39 119.32 0.12 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.803 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.51 150.41 52.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.578 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.595 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -107.22 150.38 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.303 -179.897 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.595 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.1 OUTLIER -121.75 153.28 25.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.341 -179.818 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.444 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 7.3 mt-10 -123.69 132.77 53.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.856 0.36 . . . . 0.0 110.174 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.574 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -115.84 115.2 25.84 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.44 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.506 ' HA ' ' O ' ' B' ' 410' ' ' THR . 2.1 ptm180 -143.73 -164.19 1.82 Allowed 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.173 0.511 . . . . 0.0 111.486 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.565 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -145.44 144.31 21.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.288 -179.401 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . 0.448 ' HA3' ' HG2' ' B' ' 384' ' ' ARG . . . -36.21 -29.96 0.02 OUTLIER Glycine 0 C--N 1.331 0.298 0 CA-C-N 115.744 -0.662 . . . . 0.0 113.309 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' B' ' 406' ' ' VAL . 2.8 t70 -66.08 -8.23 22.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.77 0.319 . . . . 0.0 110.899 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 86.68 39.88 7.45 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.462 -179.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.506 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 53.1 m -129.05 116.44 19.3 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.493 ' HA ' ' CB ' ' B' ' 405' ' ' ARG . 48.1 t -86.19 110.95 20.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.887 178.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.542 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.4 OUTLIER -64.49 -34.75 78.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.356 . . . . 0.0 110.304 179.742 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.435 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . -176.4 -154.9 12.24 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.677 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.467 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 12.9 t -173.78 168.99 4.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.693 0.283 . . . . 0.0 110.743 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.454 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -167.35 167.46 39.91 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.399 -0.905 . . . . 0.0 113.033 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.18 150.82 18.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 122.276 0.23 . . . . 0.0 110.388 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.537 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -160.26 143.5 9.1 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.927 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.489 ' N ' HD13 ' B' ' 422' ' ' ILE . 15.1 ptt180 -56.16 -47.04 79.01 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.623 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.5 OUTLIER -99.75 34.38 2.28 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 178.884 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.547 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.5 OUTLIER 46.35 -46.23 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 N-CA-C 115.506 1.669 . . . . 0.0 115.506 178.609 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.623 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -46.01 -48.17 16.7 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 -179.129 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.59 ' N ' ' CD ' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -48.52 -40.12 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.719 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.109 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.547 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -63.51 -44.28 94.77 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.363 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.07 -65.22 3.23 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.484 -0.865 . . . . 0.0 111.456 178.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.522 ' CD1' ' HB3' ' B' ' 367' ' ' ASP . 4.4 mm -52.94 -35.85 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.059 0.456 . . . . 0.0 110.382 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.581 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 3.6 tpt180 -63.45 -49.12 74.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.531 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.518 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -51.71 -41.73 61.7 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.287 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.566 ' CB ' ' CB ' ' B' ' 370' ' ' ALA . . . -58.76 -62.22 2.03 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.31 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.418 ' HA ' ' CG ' ' B' ' 432' ' ' LEU . 0.3 OUTLIER -53.78 -20.44 5.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.244 179.295 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.467 ' OD1' ' O ' ' B' ' 414' ' ' THR . 1.9 m-80 -76.1 -40.05 53.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.812 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.4 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -64.62 -39.08 93.07 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.253 0.549 . . . . 0.0 109.579 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.522 ' HA ' ' CD1' ' B' ' 438' ' ' LEU . 0.2 OUTLIER -85.19 8.09 19.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.538 179.008 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.85 -1.6 58.08 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.276 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.534 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 6.3 m-20 -111.44 83.56 1.79 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.918 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.479 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 1.6 ptmm? -50.75 -49.4 58.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.006 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.479 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 4.2 mmtp -61.36 -45.1 95.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.166 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.534 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 2.0 ttp -67.63 -51.45 49.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.939 0.4 . . . . 0.0 110.488 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.522 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 80.6 mt -51.13 -62.62 1.5 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.213 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -50.99 -38.72 52.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.317 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.58 ' CZ ' ' OE1' ' B' ' 444' ' ' GLN . 0.9 OUTLIER -55.23 -36.8 66.39 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.7 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.558 ' CD2' HG21 ' B' ' 378' ' ' ILE . 32.1 m-85 -73.36 -46.04 51.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.163 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . 0.416 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -41.88 -51.03 4.42 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -64.09 -42.18 97.03 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.58 ' OE1' ' CZ ' ' B' ' 440' ' ' PHE . 0.0 OUTLIER -53.59 -42.51 67.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.168 179.018 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.641 ' CZ ' ' CE1' ' B' ' 380' ' ' TYR . 40.2 mmt-85 -62.95 -38.73 92.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.624 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -67.59 -42.54 82.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.58 178.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.479 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -72.61 -82.43 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.353 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.541 ' CD1' ' O ' ' B' ' 445' ' ' ARG . 0.2 OUTLIER 26.82 96.9 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.291 -179.734 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -39.01 157.11 0.03 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.787 2.325 . . . . 0.0 112.689 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.19 -65.91 0.95 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.662 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.52 63.72 1.77 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.803 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -49.68 -44.01 47.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.09 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.261 -0.875 . . . . 0.0 110.946 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.825 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.436 1.814 0 O4'-C1'-N19 111.394 3.194 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.825 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.311 0 O4'-C1'-N19 111.184 2.984 . 0.083 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.648 " O2'" " H5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 C5'-C4'-C3' 111.074 -2.951 . 0.134 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.648 " H5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 P--O5' 1.613 1.987 0 O4'-C1'-N19 111.084 2.884 . 0.169 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.418 " C5'" ' HB3' ' B' ' 398' ' ' PRO . . . . . . . . 0 O4'--C4' 1.427 -2.143 0 C5'-C4'-C3' 111.06 -2.96 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.456 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.246 0 O4'-C1'-N19 111.481 3.281 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.797 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.056 0 O4'-C1'-N19 111.275 3.075 . 0.17 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.528 ' C4 ' ' N7 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.299 0 O4'-C1'-N19 111.106 2.906 . 0.331 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.528 ' N7 ' ' C4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.508 0 C5'-C4'-C3' 111.445 -2.703 . 0.128 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.439 ' C6 ' " H2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.04 0 O4'-C1'-N19 111.255 3.055 . 0.107 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.629 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.446 0 C5'-C4'-C3' 111.392 -2.739 . 0.07 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.813 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.876 0 O4'-C1'-N19 111.11 2.91 . 0.051 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.813 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.516 0 C3'-C2'-C1' 104.678 3.531 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.799 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.357 0 C5'-C4'-C3' 110.995 -3.004 . 0.052 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.835 " O2'" " H5'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.428 -2.108 0 C5'-C4'-C3' 111.051 -2.966 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.835 " H5'" " O2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.226 0 O4'-C1'-N19 111.588 3.388 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.564 " O2'" " C1'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.849 0 C5'-C4'-C3' 110.871 -3.086 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.648 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.953 0 C5'-C4'-C3' 111.128 -2.915 . 0.0 OUTLIER '7D dist 4n' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.612 ' H22' ' NZ ' ' B' ' 371' ' ' LYS . . . . . . . . 0 O4'--C1' 1.437 1.89 0 C5'-C4'-C3' 111.045 -2.97 . 0.395 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.82 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.845 0 C5'-C4'-C3' 110.881 -3.079 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.704 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.428 0 O4'-C1'-N19 111.226 3.026 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.888 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.978 0 O4'-C1'-N19 111.223 3.023 . 0.045 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.725 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.129 0 O4'-C1'-N19 111.866 3.666 . 0.051 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.829 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.199 0 C5'-C4'-C3' 111.293 -2.805 . 0.055 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.663 ' C2 ' ' C5 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.595 0 C3'-C2'-C1' 105.032 3.924 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.691 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.148 0 O4'-C1'-N19 111.126 2.926 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.826 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.072 0 O4'-C1'-N19 111.121 2.921 . 0.063 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.826 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.512 0 C3'-C2'-C1' 104.984 3.871 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.685 " H5'" " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.059 0 O4'-C1'-N19 111.199 2.999 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 1.011 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.318 0 O4'-C1'-N19 111.362 3.162 . 0.052 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 1.011 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.284 0 O4'-C1'-N19 111.508 3.308 . 0.206 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.324 0 O4'-C1'-N19 111.298 3.098 . 0.066 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.212 0 N-CA-C 112.558 -0.217 . . . . 0.0 112.558 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 365' ' ' SER . . . . . 0.541 ' CB ' ' OP1' ' A' ' 15' ' ' ' A' . 24.9 p -102.7 31.79 3.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.794 0.331 . . . . 0.0 111.035 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' B' ' 366' ' ' LEU . 5.0 tp -60.4 -14.34 18.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.984 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.437 ' O ' ' HG2' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -41.59 -69.07 0.15 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.978 179.387 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.513 ' N ' ' HE3' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -36.09 -66.7 0.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.617 179.6 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -38.23 -48.87 1.33 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.5 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.496 ' CB ' ' HB2' ' B' ' 428' ' ' ALA . . . -60.38 -80.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.245 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.612 ' NZ ' ' H22' ' A' ' 19' ' ' ' G' . 0.0 OUTLIER -33.61 -40.44 0.07 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.99 0.424 . . . . 0.0 110.725 179.761 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.571 ' HG2' ' N3 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -57.13 -59.61 4.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.102 179.191 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.514 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -47.62 -49.46 27.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.171 0.51 . . . . 0.0 111.215 179.615 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.527 ' N ' HD23 ' B' ' 374' ' ' LEU . 0.9 OUTLIER -52.28 -70.51 0.09 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.263 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.537 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.5 m-85 -80.72 -48.33 12.7 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -177.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.528 ' CB ' ' HD2' ' B' ' 372' ' ' ARG . 8.2 t -59.88 -26.45 65.88 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 -178.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 4.4 mm? -120.63 -25.24 5.56 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -178.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.519 HG13 ' CD2' ' B' ' 438' ' ' LEU . 3.1 mm -133.23 35.91 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.537 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -140.97 82.73 0.23 Allowed Glycine 0 C--N 1.33 0.215 0 C-N-CA 120.084 -1.055 . . . . 0.0 113.344 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.565 ' CD2' ' HD3' ' B' ' 445' ' ' ARG . 15.7 p90 -99.39 24.34 8.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.103 0.477 . . . . 0.0 109.872 178.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.487 ' HB1' ' O ' ' B' ' 380' ' ' TYR . . . 80.04 -89.46 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.497 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.442 ' C ' ' O ' ' B' ' 381' ' ' ALA . 55.6 m -33.2 -38.53 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.3 -179.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.498 ' HG ' ' CZ ' ' B' ' 380' ' ' TYR . 0.7 OUTLIER -41.49 -39.7 1.6 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.9 0.381 . . . . 0.0 110.968 -179.612 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.06 35.87 2.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.42 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.557 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 8.9 tt -75.03 123.86 25.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.547 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -147.9 147.35 29.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.539 0.685 . . . . 0.0 112.194 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.564 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 4.4 m-85 -92.47 155.43 17.85 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.935 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.36 125.19 53.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 4.3 m -88.72 131.53 34.99 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.597 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.494 ' O ' HG21 ' B' ' 401' ' ' ILE . 16.3 m -137.16 158.27 35.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.324 0.583 . . . . 0.0 111.454 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.548 ' HB2' ' CG2' ' B' ' 401' ' ' ILE . 0.1 OUTLIER 79.54 64.38 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.361 179.626 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.478 ' HA ' ' HD2' ' B' ' 393' ' ' PRO . 0.4 OUTLIER -39.46 103.79 0.3 Allowed Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.642 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.478 ' HD2' ' HA ' ' B' ' 392' ' ' LYS . 1.8 Cg_endo -45.99 165.52 0.07 OUTLIER 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.81 2.34 . . . . 0.0 112.961 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 3.1 p -124.38 162.27 24.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.671 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -85.4 12.44 8.32 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.509 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 20.3 m -141.5 10.0 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.249 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.533 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 0.2 OUTLIER -174.32 51.04 0.1 OUTLIER Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.465 -179.796 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.533 ' CD ' ' N ' ' B' ' 397' ' ' ASP . 95.4 Cg_exo -31.21 -29.52 0.02 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 124.164 3.242 . . . . 0.0 114.105 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.515 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.5 p-10 -37.06 129.38 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.822 0.344 . . . . 0.0 111.0 -179.311 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 28.4 t -143.94 158.56 43.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.237 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.548 ' CG2' ' HB2' ' B' ' 391' ' ' LYS . 0.5 OUTLIER -116.25 144.55 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-O 121.182 0.515 . . . . 0.0 111.771 -179.438 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.538 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.0 OUTLIER -127.11 128.67 70.71 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.603 179.951 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.503 ' CG ' ' OG1' ' B' ' 414' ' ' THR . 2.9 mt-10 -110.64 131.49 55.01 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.609 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.564 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 1.4 p -93.63 141.17 28.79 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.545 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.9 OUTLIER -162.16 -175.28 4.5 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.275 0.56 . . . . 0.0 112.345 -179.552 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.557 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -136.69 145.75 29.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.954 -179.622 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -34.89 -34.44 0.05 OUTLIER Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.654 -0.703 . . . . 0.0 113.742 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -60.82 -12.97 12.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.974 0.416 . . . . 0.0 110.726 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 91.03 36.3 6.75 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.722 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.545 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 18.5 m -118.65 116.46 26.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.538 0.209 . . . . 0.0 111.312 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.484 ' HA ' ' CB ' ' B' ' 405' ' ' ARG . 33.7 t -82.88 96.64 3.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.176 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.487 HD22 ' CA ' ' B' ' 405' ' ' ARG . 0.2 OUTLIER -50.89 -26.16 5.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.963 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.51 ' N ' ' SG ' ' B' ' 404' ' ' CYS . . . -177.44 -177.26 46.17 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 119.462 -1.351 . . . . 0.0 113.954 -179.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.503 ' OG1' ' CG ' ' B' ' 403' ' ' GLU . 6.3 m -148.56 120.08 7.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.28 -0.46 . . . . 0.0 110.469 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.514 ' O ' ' CD1' ' B' ' 401' ' ' ILE . . . -130.48 163.77 23.11 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.419 -0.895 . . . . 0.0 113.152 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.452 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 3.2 p -135.33 161.06 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.763 -0.218 . . . . 0.0 110.416 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.515 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -155.87 115.61 0.67 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.043 -1.075 . . . . 0.0 113.424 -179.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.518 ' N ' HD12 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -44.55 -54.82 5.67 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 122.189 0.196 . . . . 0.0 111.337 179.6 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.554 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.7 OUTLIER -86.98 -5.92 58.93 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.111 178.865 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.554 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 0.6 OUTLIER 94.46 -45.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 C-N-CA 123.65 0.78 . . . . 0.0 112.262 179.5 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -47.03 -60.56 2.37 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.616 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.616 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.0 OUTLIER -42.26 -32.69 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.509 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.973 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.531 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -68.09 -45.95 72.34 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.146 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.509 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.54 -58.19 12.16 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 119.81 -1.186 . . . . 0.0 111.519 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.469 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 1.9 mm -59.57 -36.28 64.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.768 0.318 . . . . 0.0 110.744 179.415 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.4 OUTLIER -62.15 -56.03 22.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.063 179.489 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.519 ' CB ' ' HB ' ' B' ' 402' ' ' VAL . . . -45.02 -42.3 8.24 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.017 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.496 ' HB2' ' CB ' ' B' ' 370' ' ' ALA . . . -53.62 -66.17 0.44 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.004 178.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.513 ' O ' ' N ' ' B' ' 433' ' ' ARG . 1.1 mt-10 -47.27 -44.37 22.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.687 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.448 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 0.7 OUTLIER -55.87 -29.49 60.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.909 179.685 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.449 ' O ' ' HE2' ' B' ' 437' ' ' MET . . . -72.3 -48.45 42.12 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 120.826 0.346 . . . . 0.0 110.421 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.558 ' CA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -97.05 13.36 29.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.818 179.437 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -87.07 7.24 28.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.982 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.545 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 2.0 m-20 -117.65 74.65 0.94 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.918 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.435 ' C ' ' O ' ' B' ' 434' ' ' ASP . 14.3 ptmt -36.84 -43.85 0.46 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.499 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.432 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.1 OUTLIER -64.36 -47.92 77.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.397 179.768 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.545 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 2.0 ttp -60.79 -51.46 69.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.416 179.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.558 HD11 ' CA ' ' B' ' 432' ' ' LEU . 60.0 mt -58.0 -57.78 11.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.592 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -53.02 -30.42 35.28 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.914 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.6 OUTLIER -66.38 -40.85 89.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.501 179.191 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.533 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 42.9 m-85 -75.12 -49.49 19.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.812 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -41.48 -46.32 3.44 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -38.88 81.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.355 178.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.533 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -60.08 -26.78 66.44 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.119 179.122 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.566 ' O ' ' CG1' ' B' ' 448' ' ' ILE . 1.4 mmm180 -77.73 -45.89 23.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.563 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -55.76 -39.23 70.9 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.163 0.506 . . . . 0.0 109.793 179.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.513 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -73.97 -91.33 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.256 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.566 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 0.8 OUTLIER 18.04 91.73 0.04 OUTLIER Pre-proline 0 N--CA 1.466 0.328 0 O-C-N 123.735 0.647 . . . . 0.0 111.966 -179.679 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -40.3 -37.94 2.11 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 122.949 2.432 . . . . 0.0 112.681 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . 0.413 ' C ' ' OG ' ' B' ' 451' ' ' SER . 0.0 OUTLIER -41.73 141.23 0.83 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.915 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 451' ' ' SER . . . . . 0.413 ' OG ' ' C ' ' B' ' 450' ' ' ARG . 0.0 OUTLIER 67.74 67.77 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.994 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -174.86 167.21 3.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.814 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.902 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.831 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.849 0 C3'-C2'-C1' 104.398 3.22 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.831 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.128 0 O4'-C1'-N19 111.13 2.93 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.508 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.791 0 C3'-C2'-C1' 104.88 3.756 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.508 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.268 0 O4'-C1'-N19 111.244 3.044 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.538 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.298 0 O4'-C1'-N19 111.259 3.059 . 0.326 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.649 " O2'" " H5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.178 0 C5'-C4'-C3' 111.116 -2.922 . 0.162 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.742 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.435 1.789 0 O4'-C1'-N19 111.444 3.244 . 0.23 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.412 ' C6 ' " H2'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.244 0 O4'-C1'-N19 111.138 2.938 . 0.132 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.402 ' N7 ' ' C4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.373 0 O4'-C1'-N19 111.19 2.99 . 0.07 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.5 " O2'" " O5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.575 0 O4'-C1'-N19 111.186 2.986 . 0.204 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.587 " O2'" " O4'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.599 0 O4'-C1'-N19 110.983 2.783 . 0.047 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.771 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.938 0 O4'-C1'-N19 111.329 3.129 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.771 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.313 0 C3'-C2'-C1' 104.518 3.353 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.654 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.054 0 C5'-C4'-C3' 111.108 -2.928 . 0.034 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.911 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.422 0 C5'-C4'-C3' 111.035 -2.976 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.911 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.929 0 C5'-C4'-C3' 110.88 -3.08 . 0.157 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.582 " O2'" " O4'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.201 0 C5'-C4'-C3' 110.925 -3.05 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.644 ' H61' " C2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.824 0 O4'-C1'-N19 111.012 2.812 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.438 " H2'" ' C8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.827 0 C5'-C4'-C3' 110.859 -3.094 . 0.099 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.649 " O2'" " C5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.9 0 C5'-C4'-C3' 110.709 -3.194 OUTLIER-DELTA 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.649 " C5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.613 2.026 0 O4'-C1'-N19 111.273 3.073 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.865 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.613 2.04 0 O4'-C1'-N19 111.318 3.118 . 0.019 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.805 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.258 0 O4'-C1'-N19 111.058 2.858 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.634 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.684 0 C3'-C2'-C1' 104.848 3.72 . 0.016 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.6 " O5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.443 2.434 0 O4'-C1'-N19 111.147 2.947 . 0.064 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.563 " O2'" " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.776 0 C5'-C4'-C3' 111.118 -2.922 . 0.092 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.764 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.145 0 O4'-C1'-N19 111.253 3.053 . 0.169 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.764 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.687 0 C3'-C2'-C1' 104.787 3.652 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.812 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.161 0 O4'-C1'-N19 111.315 3.115 . 0.111 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 1.028 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.353 0 O4'-C1'-N19 111.606 3.406 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 1.028 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.507 0 O4'-C1'-N19 111.277 3.077 . 0.178 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.515 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.373 0 O4'-C1'-N19 111.228 3.028 . 0.43 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.093 0 N-CA-C 112.342 -0.303 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 31.6 m 55.31 46.16 24.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.722 0.296 . . . . 0.0 110.836 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.443 ' HB3' ' HB2' ' B' ' 369' ' ' ASN . 0.3 OUTLIER -139.38 126.55 21.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.307 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.456 ' HB2' ' NZ ' ' B' ' 371' ' ' LYS . 0.6 OUTLIER -52.9 -68.03 0.2 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.667 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.495 ' HA ' ' CD ' ' B' ' 371' ' ' LYS . 4.2 tmm? -39.58 -46.36 1.76 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.666 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.443 ' HB2' ' HB3' ' B' ' 366' ' ' LEU . 0.9 OUTLIER -56.45 -52.75 63.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.411 179.756 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.527 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -50.9 -69.78 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.022 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.517 ' HG2' HO2' ' A' ' 20' ' ' ' A' . 5.1 mttp -31.36 -53.71 0.23 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.124 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.535 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.7 ttt-85 -51.59 -45.92 63.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.553 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -57.14 -47.02 82.18 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.173 0.511 . . . . 0.0 110.737 179.491 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.427 ' O ' ' C ' ' B' ' 378' ' ' ILE . 3.6 mt -53.91 -68.57 0.17 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -179.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.602 ' CE2' ' OP1' ' A' ' 20' ' ' ' A' . 3.6 m-30 -85.73 -42.21 14.44 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -177.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.7 OUTLIER -67.84 -27.94 67.13 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.218 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -106.32 -31.34 8.66 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.773 0.32 . . . . 0.0 110.765 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.462 ' O ' ' C ' ' B' ' 379' ' ' GLY . 1.3 mm -137.24 -148.08 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.462 ' C ' ' O ' ' B' ' 378' ' ' ILE . . . 28.73 72.83 0.04 OUTLIER Glycine 0 C--N 1.332 0.359 0 C-N-CA 121.23 -0.509 . . . . 0.0 113.45 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.584 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 10.4 p90 -89.93 -55.41 3.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.662 0.268 . . . . 0.0 111.116 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -176.69 -48.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.817 0.342 . . . . 0.0 111.366 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.48 16.65 4.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.124 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.413 HD21 HG21 ' B' ' 378' ' ' ILE . 2.9 tp -103.21 -27.77 12.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.028 0.442 . . . . 0.0 110.807 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 8.0 tpp85 62.32 15.71 7.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.971 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.573 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 6.5 tt -48.02 128.74 14.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.702 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.552 ' O ' ' CD2' ' B' ' 386' ' ' HIS . 0.6 OUTLIER -158.59 136.95 10.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.304 0.573 . . . . 0.0 112.25 -179.639 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.584 ' CZ ' ' HB3' ' B' ' 404' ' ' CYS . 6.9 m-85 -87.86 162.93 16.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.578 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.555 HG22 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -138.35 147.58 25.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.97 178.498 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.12 109.94 19.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 0.0 110.668 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.518 ' O ' HG21 ' B' ' 401' ' ' ILE . 29.7 m -112.51 155.13 13.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.559 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.41 ' CB ' ' CG2' ' B' ' 401' ' ' ILE . 0.0 OUTLIER 67.68 69.38 0.35 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.413 -179.665 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.407 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 17.0 mmtt -54.56 149.27 21.88 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.097 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.525 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 11.2 Cg_exo -72.55 165.06 33.8 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 123.081 2.521 . . . . 0.0 112.526 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.465 HG21 ' O ' ' B' ' 393' ' ' PRO . 1.2 p -156.47 165.84 35.14 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.498 179.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -79.37 4.78 14.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.846 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.484 ' O ' ' HB3' ' B' ' 397' ' ' ASP . 6.1 m -130.99 17.06 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.292 0.568 . . . . 0.0 109.558 178.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.484 ' HB3' ' O ' ' B' ' 396' ' ' VAL . 2.8 p30 166.02 60.42 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.967 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.525 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 96.3 Cg_exo -39.4 -54.72 1.76 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.045 2.497 . . . . 0.0 112.934 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.478 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.8 OUTLIER -21.65 137.01 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.402 -178.558 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -143.69 141.53 30.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.973 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.531 ' CG1' ' O ' ' B' ' 415' ' ' GLY . 0.1 OUTLIER -111.16 139.0 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 CA-C-O 121.465 0.65 . . . . 0.0 111.776 -179.055 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.518 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.2 OUTLIER -102.27 176.65 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.055 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.555 ' CB ' HG22 ' B' ' 388' ' ' VAL . 4.9 mt-10 -156.2 106.98 2.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.984 0.421 . . . . 0.0 110.833 179.297 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.584 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -88.64 128.45 35.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.463 ' HA ' ' O ' ' B' ' 410' ' ' THR . 12.5 ptt180 -155.19 173.09 17.11 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.642 -179.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.573 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -132.81 132.59 59.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.87 -179.249 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' B' ' 406' ' ' VAL . . . -30.95 -32.14 0.01 OUTLIER Glycine 0 C--N 1.333 0.407 0 O-C-N 123.436 0.46 . . . . 0.0 113.555 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . 0.545 ' N ' ' O ' ' B' ' 406' ' ' VAL . 21.4 t0 -57.17 -16.42 7.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.014 0.435 . . . . 0.0 110.387 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 95.72 35.86 5.49 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.785 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.469 ' HB ' HG21 ' B' ' 406' ' ' VAL . 16.9 m -128.28 124.79 37.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.082 0.468 . . . . 0.0 111.737 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.471 HG11 ' O ' ' B' ' 413' ' ' GLY . 47.9 t -89.2 89.43 3.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.525 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.526 HD11 ' CE ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -46.01 -26.44 0.73 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.897 0.38 . . . . 0.0 110.23 -179.928 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.471 ' O ' HG11 ' B' ' 411' ' ' VAL . . . 177.61 -173.77 46.37 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.858 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.467 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 3.4 t -160.64 171.37 19.03 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.531 ' O ' ' CG1' ' B' ' 401' ' ' ILE . . . -173.01 170.41 43.56 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 118.525 -1.798 . . . . 0.0 114.836 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.511 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 5.2 p -136.76 152.05 28.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.321 -0.439 . . . . 0.0 110.209 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.479 ' HA3' HD11 ' B' ' 422' ' ' ILE . . . -153.66 111.54 0.49 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.904 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.518 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -42.05 -56.77 2.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.739 0.304 . . . . 0.0 110.923 179.706 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.603 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.1 OUTLIER -82.7 -11.27 58.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.248 179.151 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.603 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 97.12 -44.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.249 0 C-N-CA 123.873 0.869 . . . . 0.0 111.903 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.513 ' HE3' " O3'" ' A' ' 22' ' ' ' C' . 0.5 OUTLIER -48.08 -59.31 3.48 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.534 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.561 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -41.86 -31.42 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 177.845 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.523 ' CB ' ' O ' ' B' ' 420' ' ' ILE . . . -71.65 -45.33 62.34 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.687 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.11 -59.9 9.27 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 119.906 -1.14 . . . . 0.0 111.702 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.489 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 1.2 mm -57.84 -51.23 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.89 0.376 . . . . 0.0 110.797 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.561 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -46.37 -51.17 15.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.237 179.687 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -51.1 -54.15 27.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.807 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.519 ' HB2' ' CB ' ' B' ' 370' ' ' ALA . . . -51.94 -65.5 0.55 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.253 0.549 . . . . 0.0 110.639 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.495 ' O ' ' HB2' ' B' ' 433' ' ' ARG . 55.9 mt-10 -52.87 -19.52 2.61 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.443 179.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.481 ' ND2' ' HG3' ' B' ' 426' ' ' ARG . 0.8 OUTLIER -77.97 -32.47 51.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.34 -179.795 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.3 -42.53 44.96 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.345 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.531 ' HA ' ' CD1' ' B' ' 438' ' ' LEU . 0.0 OUTLIER -87.33 14.48 7.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.759 179.807 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . 0.495 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 8.2 ttt85 -88.01 4.65 44.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.67 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.518 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 12.7 m-20 -116.07 72.37 0.81 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.074 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.505 ' HG3' ' N ' ' B' ' 436' ' ' LYS . 15.2 ptpt -41.69 -47.33 3.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.686 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.505 ' N ' ' HG3' ' B' ' 435' ' ' LYS . 1.7 mmmm -58.4 -47.63 83.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.146 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.526 ' CE ' HD11 ' B' ' 412' ' ' LEU . 13.2 tmm? -65.79 -54.7 23.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.012 0.434 . . . . 0.0 109.864 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.531 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 99.2 mt -51.61 -68.07 0.2 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.221 179.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -44.41 -36.2 2.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.859 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.633 ' CE2' ' CE1' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -60.98 -41.91 97.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.26 0.552 . . . . 0.0 109.639 179.692 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.633 ' CE1' ' CE2' ' B' ' 440' ' ' PHE . 40.9 m-85 -75.54 -33.7 60.7 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.545 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.81 -46.1 64.14 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.93 -45.62 77.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.479 178.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.545 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -57.99 -25.92 61.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.306 179.376 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.584 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -88.9 -24.38 22.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.434 -179.283 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -80.64 -41.16 24.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.929 0.395 . . . . 0.0 110.471 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.437 ' O ' ' N ' ' B' ' 449' ' ' PRO . . . -68.94 -50.55 48.33 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.188 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.53 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 3.8 pt -30.53 92.92 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.874 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . 0.437 ' N ' ' O ' ' B' ' 447' ' ' ALA . 72.5 Cg_exo -48.08 -37.28 30.16 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.798 2.332 . . . . 0.0 111.881 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 50.46 -159.38 0.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.973 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 52.12 89.68 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.944 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -98.46 -49.9 4.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.86 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 8.5 t . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.921 179.967 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.695 " O2'" ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.846 0 C3'-C2'-C1' 104.458 3.287 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.719 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 1.959 0 O4'-C1'-N19 111.294 3.094 . 0.03 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.719 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.357 0 O4'-C1'-N19 111.017 2.817 . 0.244 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.441 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.206 0 C5'-C4'-C3' 111.227 -2.849 . 0.036 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.525 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.104 0 O4'-C1'-N19 111.462 3.262 . 0.254 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.439 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.281 0 O4'-C1'-N19 111.168 2.968 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.802 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.98 0 O4'-C1'-N19 111.291 3.091 . 0.154 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.682 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.195 0 O4'-C1'-N19 111.12 2.92 . 0.235 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.682 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.31 0 O4'-C1'-N19 110.986 2.786 . 0.1 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.858 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.873 0 C5'-C4'-C3' 111.045 -2.97 . 0.094 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.64 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.464 0 O4'-C1'-N19 111.343 3.143 . 0.061 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.733 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.942 0 C5'-C4'-C3' 111.111 -2.926 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.733 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.345 0 C3'-C2'-C1' 104.468 3.298 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.757 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.284 0 C5'-C4'-C3' 111.111 -2.926 . 0.247 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.873 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.435 1.78 0 C5'-C4'-C3' 110.898 -3.068 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.873 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.381 0 O4'-C1'-N19 111.418 3.218 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.756 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.143 0 O4'-C1'-N19 111.255 3.055 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.755 " O5'" ' H8 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.727 0 C5'-C4'-C3' 110.888 -3.075 OUTLIER-DELTA 0.0 OUTLIER '7D dist 2a' 0.0 . . . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.612 ' H22' ' CE ' ' B' ' 371' ' ' LYS . . . . . . . . 0 O4'--C1' 1.439 2.091 0 O4'-C1'-N19 111.162 2.962 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.829 " H2'" " O4'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.434 1.693 0 C5'-C4'-C3' 110.984 -3.011 . 0.219 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.829 " O4'" " H2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.386 0 C3'-C2'-C1' 104.448 3.276 . 0.029 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.855 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.873 0 O4'-C1'-N19 111.217 3.017 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.632 " O2'" " C5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.172 0 O4'-C1'-N19 111.77 3.57 . 0.029 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.88 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.181 0 C5'-C4'-C3' 111.43 -2.713 . 0.056 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.506 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.288 0 O4'-C1'-N19 111.23 3.03 . 0.562 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.62 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.518 0 C5'-C4'-C3' 111.19 -2.873 . 0.078 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.799 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.036 0 O4'-C1'-N19 111.153 2.953 . 0.159 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.799 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.614 0 C3'-C2'-C1' 104.955 3.839 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.719 ' H6 ' " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.194 0 O4'-C1'-N19 111.319 3.119 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 1.008 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.327 0 O4'-C1'-N19 111.628 3.428 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 1.008 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.787 0 C3'-C2'-C1' 104.566 3.406 . 0.059 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.556 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.862 0 C3'-C2'-C1' 104.21 3.011 . 0.297 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.636 -0.186 . . . . 0.0 112.636 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 365' ' ' SER . . . . . 0.48 ' O ' ' CB ' ' B' ' 366' ' ' LEU . 1.6 t -88.09 17.13 5.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.977 0.418 . . . . 0.0 110.708 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.48 ' CB ' ' O ' ' B' ' 365' ' ' SER . 0.1 OUTLIER 83.49 -35.15 0.07 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.738 179.709 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.472 ' OD1' ' N ' ' B' ' 367' ' ' ASP . 0.5 OUTLIER -42.91 -78.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.774 0.321 . . . . 0.0 110.4 179.867 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.603 ' CE ' ' ND2' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -37.49 -44.75 0.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.54 -179.846 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.603 ' ND2' ' CE ' ' B' ' 368' ' ' MET . 5.2 m-20 -52.1 -57.97 7.96 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.057 0.456 . . . . 0.0 110.337 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.519 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -57.66 -72.51 0.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.622 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.612 ' CE ' ' H22' ' A' ' 19' ' ' ' G' . 0.0 OUTLIER -36.04 -31.92 0.03 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.977 0.418 . . . . 0.0 110.21 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.631 ' CG ' ' N3 ' ' A' ' 18' ' ' ' A' . 0.1 OUTLIER -65.42 -54.02 34.7 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.56 178.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.543 ' HG3' ' CB ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -53.73 -37.89 63.8 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.367 0.603 . . . . 0.0 110.328 179.017 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' B' ' 379' ' ' GLY . 2.9 mt -64.56 -79.37 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -178.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -85.47 12.42 8.49 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.581 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -127.2 -15.38 5.24 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.686 -0.406 . . . . 0.0 111.741 179.805 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.525 ' O ' ' CD1' ' B' ' 378' ' ' ILE . 9.0 mp -124.98 -21.77 4.62 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.808 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.632 ' CG2' ' CG ' ' B' ' 441' ' ' TYR . 12.1 mm -137.41 -72.39 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.54 ' N ' ' O ' ' B' ' 374' ' ' LEU . . . -47.14 79.45 0.0 OUTLIER Glycine 0 CA--C 1.52 0.37 0 CA-C-N 116.201 -0.454 . . . . 0.0 113.807 -179.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.553 ' N ' ' O ' ' B' ' 378' ' ' ILE . 45.3 p90 -76.9 -161.07 0.18 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.649 0.261 . . . . 0.0 111.058 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.553 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -84.7 105.73 15.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.693 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.553 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.1 t 91.22 47.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.719 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.455 HD12 ' HA2' ' B' ' 379' ' ' GLY . 4.5 tt -101.93 -23.21 14.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.889 0.376 . . . . 0.0 110.276 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.493 ' O ' ' ND1' ' B' ' 386' ' ' HIS . 13.7 tpt180 81.28 5.0 1.4 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.354 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.587 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 6.1 tt -57.13 135.23 56.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.945 0.403 . . . . 0.0 110.376 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.493 ' ND1' ' O ' ' B' ' 384' ' ' ARG . 18.3 p-80 -167.05 147.41 5.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.405 0.621 . . . . 0.0 112.375 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.524 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 4.1 m-85 -98.85 138.66 35.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.385 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.41 HG21 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -118.01 118.77 59.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.298 0.57 . . . . 0.0 110.629 179.272 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 53.9 m -78.64 129.19 34.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.982 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.523 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 27.3 m -136.71 154.29 31.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.666 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 84.88 49.27 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.354 -179.539 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.444 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER -29.76 109.44 0.25 Allowed Pre-proline 0 N--CA 1.462 0.144 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.33 -179.433 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.471 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 1.9 Cg_endo -48.01 158.54 0.84 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 122.816 2.344 . . . . 0.0 113.422 -179.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.429 ' OG1' ' CG ' ' B' ' 397' ' ' ASP . 40.2 p -124.69 165.01 18.69 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.729 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -88.63 15.8 7.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.802 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.574 ' CG2' ' O ' ' B' ' 396' ' ' VAL . 0.2 OUTLIER -141.6 9.56 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.937 0.875 . . . . 0.0 109.909 179.51 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.429 ' CG ' ' OG1' ' B' ' 394' ' ' THR . 3.5 p-10 171.22 59.12 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.543 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.481 ' O ' ' C ' ' B' ' 399' ' ' ASN . 5.2 Cg_exo -39.34 -31.55 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 123.611 2.874 . . . . 0.0 112.412 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.491 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 13.9 m120 -25.38 109.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.568 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 400' ' ' SER . . . . . 0.406 ' O ' ' HA ' ' B' ' 416' ' ' VAL . 12.9 m -127.92 162.53 26.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.605 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.55 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.6 OUTLIER -119.78 151.01 22.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.517 -179.882 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.55 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.1 OUTLIER -120.27 154.3 23.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.453 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 13.6 mm-40 -122.81 130.15 52.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.809 0.338 . . . . 0.0 110.685 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.532 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.5 OUTLIER -112.43 112.67 24.39 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.842 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.52 ' CG ' ' N ' ' B' ' 406' ' ' VAL . 0.1 OUTLIER -138.64 -166.33 1.99 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 121.349 0.595 . . . . 0.0 111.888 -178.823 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.587 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -157.79 140.4 6.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.328 -179.354 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . 0.44 ' HA2' ' HG2' ' B' ' 384' ' ' ARG . . . 64.78 6.73 25.24 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.551 -0.833 . . . . 0.0 111.322 -178.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 20.6 t70 72.41 35.45 1.17 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.685 0.279 . . . . 0.0 111.11 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -155.73 -49.46 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.497 -0.858 . . . . 0.0 113.22 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.488 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 53.4 m -82.12 105.65 13.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.681 0.277 . . . . 0.0 111.68 -179.4 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.408 ' CG1' ' OE1' ' B' ' 403' ' ' GLU . 79.1 t -90.06 111.07 22.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.651 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.4 OUTLIER -64.65 -35.23 80.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.313 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.461 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 175.76 -148.68 9.5 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.561 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.501 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 8.7 t -168.53 166.84 11.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.776 0.322 . . . . 0.0 111.301 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.429 ' HA3' ' CG ' ' B' ' 426' ' ' ARG . . . -154.8 136.87 5.38 Favored Glycine 0 C--O 1.228 -0.259 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.679 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.416 HG21 ' N ' ' B' ' 417' ' ' GLY . 8.4 p -122.69 149.19 26.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.555 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -163.63 151.88 21.57 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.135 -1.031 . . . . 0.0 113.24 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.517 ' N ' HD12 ' B' ' 422' ' ' ILE . 0.6 OUTLIER -62.83 -45.45 92.56 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.359 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.623 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.5 OUTLIER -100.02 32.19 3.03 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.892 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.543 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 47.42 -44.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 178.499 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.623 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -47.88 -45.46 30.45 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 119.12 0.873 . . . . 0.0 108.93 -179.219 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.591 ' N ' ' CD ' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -49.95 -40.55 16.68 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.785 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 177.873 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.543 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -62.2 -46.04 90.66 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.492 178.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.49 -70.03 1.13 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.404 -0.903 . . . . 0.0 111.604 178.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.471 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 0.5 OUTLIER -50.92 -33.47 12.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.315 179.284 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.586 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 1.5 tpt180 -63.76 -57.89 8.56 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.513 179.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.515 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . . . -42.97 -39.59 2.66 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.506 ' CB ' ' HB3' ' B' ' 370' ' ' ALA . . . -60.29 -60.46 3.78 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.515 ' O ' HD22 ' B' ' 432' ' ' LEU . 32.2 mt-10 -47.66 -21.28 0.35 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.281 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.501 ' ND2' ' O ' ' B' ' 414' ' ' THR . 1.7 m-80 -81.57 -36.48 29.01 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.741 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.434 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -63.62 -38.38 90.91 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.161 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.543 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.0 OUTLIER -94.08 11.68 29.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.991 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . 0.463 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 0.9 OUTLIER -92.8 4.62 53.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.142 -179.79 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.499 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 15.6 m-20 -119.31 92.14 3.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 0.0 110.85 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.438 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -56.38 -46.43 80.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.476 -179.635 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.438 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -60.61 -42.14 96.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.943 0.401 . . . . 0.0 110.548 -179.8 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.514 ' SD ' ' CD1' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -71.37 -46.49 60.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.164 179.442 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.458 HD23 ' HA ' ' B' ' 432' ' ' LEU . 54.5 mt -56.12 -65.41 0.61 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.115 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -51.16 -36.48 41.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.97 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.464 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.9 OUTLIER -53.55 -44.42 69.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.67 179.642 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.632 ' CG ' ' CG2' ' B' ' 378' ' ' ILE . 43.0 m-85 -65.16 -49.47 69.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.539 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . 0.412 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -39.24 -51.19 1.99 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -38.81 92.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.979 178.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.517 ' N ' ' O ' ' B' ' 441' ' ' TYR . 3.5 mt-30 -64.6 -36.76 85.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.044 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.523 ' O ' ' CG1' ' B' ' 448' ' ' ILE . 0.0 OUTLIER -62.66 -51.82 65.73 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.57 179.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -63.84 -36.13 82.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.091 0.472 . . . . 0.0 110.519 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.467 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -67.44 -69.45 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.177 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.523 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 2.9 pt -28.4 138.6 0.11 Allowed Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.843 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . 0.454 ' O ' ' O ' ' B' ' 448' ' ' ILE . 73.2 Cg_exo -43.26 177.02 0.0 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.265 0 C-N-CA 123.193 2.595 . . . . 0.0 112.548 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . 0.422 ' O ' ' O ' ' B' ' 451' ' ' SER . 0.1 OUTLIER 50.97 -176.12 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.915 179.902 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 451' ' ' SER . . . . . 0.483 ' O ' ' N ' ' B' ' 453' ' ' SER . 0.3 OUTLIER 55.72 158.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.029 179.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 63.5 -69.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.732 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 453' ' ' SER . . . . . 0.483 ' N ' ' O ' ' B' ' 451' ' ' SER . 0.7 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.168 -0.92 . . . . 0.0 110.768 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.725 " O2'" ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.644 0 C3'-C2'-C1' 104.411 3.235 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.816 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.443 2.376 0 O4'-C1'-N19 111.213 3.013 . 0.129 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.816 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.379 0 O4'-C1'-N19 111.087 2.887 . 0.097 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.516 " O2'" " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.324 0 O4'-C1'-N19 111.324 3.124 . 0.147 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.516 " O5'" " O2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.103 0 O4'-C1'-N19 111.193 2.993 . 0.103 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.476 " H5'" " O2'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.664 0 C3'-C2'-C1' 104.249 3.055 . 0.021 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.462 " C5'" " O2'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.005 0 O4'-C1'-N19 111.534 3.334 . 0.157 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.619 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.237 0 O4'-C1'-N19 111.165 2.965 . 0.192 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.619 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.443 0 O4'-C1'-N19 111.128 2.928 . 0.068 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.825 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.853 0 O4'-C1'-N19 111.21 3.01 . 0.091 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.64 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.378 0 O4'-C1'-N19 111.206 3.006 . 0.056 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.728 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.848 0 O4'-C1'-N19 111.138 2.938 . 0.03 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.728 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.328 0 C3'-C2'-C1' 104.384 3.205 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.636 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.28 0 C5'-C4'-C3' 111.234 -2.844 . 0.071 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.828 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.428 -2.105 0 C5'-C4'-C3' 110.824 -3.117 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.828 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.147 0 O4'-C1'-N19 111.284 3.084 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.645 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.432 -1.717 0 C5'-C4'-C3' 110.885 -3.077 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.665 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.888 0 C5'-C4'-C3' 111.067 -2.955 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.583 " O4'" " O2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.392 0 C5'-C4'-C3' 111.267 -2.822 . 0.352 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.828 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.913 0 C5'-C4'-C3' 110.95 -3.033 . 0.198 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.828 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.471 0 C5'-C4'-C3' 110.941 -3.039 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.827 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.117 0 C5'-C4'-C3' 111.224 -2.851 . 0.146 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.818 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.336 0 O4'-C1'-N19 111.673 3.473 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.734 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.171 0 O4'-C1'-N19 110.917 2.717 . 0.101 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.509 " H5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.362 0 O4'-C1'-N19 111.237 3.037 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.6 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.511 0 C5'-C4'-C3' 111.003 -2.998 . 0.072 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.982 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.086 0 O4'-C1'-N19 111.069 2.869 . 0.321 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.982 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.336 0 O4'-C1'-N19 111.227 3.027 . 0.173 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.881 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.267 0 O4'-C1'-N19 110.962 2.762 . 0.204 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.974 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.338 0 O4'-C1'-N19 111.241 3.041 . 0.246 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.974 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.721 0 O4'-C1'-N19 111.313 3.113 . 0.152 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.305 0 C5'-C4'-C3' 111.262 -2.826 . 0.465 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.459 -0.257 . . . . 0.0 112.459 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 32.4 m -134.16 76.68 1.66 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.641 0.258 . . . . 0.0 110.97 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.91 176.35 1.66 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.96 0.409 . . . . 0.0 110.942 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.519 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.2 OUTLIER -47.63 -69.55 0.12 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.936 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.547 ' SD ' " O2'" ' A' ' 15' ' ' ' A' . 1.7 ttp -36.17 -43.0 0.33 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.509 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -64.27 -43.27 95.34 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.85 0.357 . . . . 0.0 110.681 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.539 ' CB ' ' HB1' ' B' ' 428' ' ' ALA . . . -65.75 -74.87 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.438 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.537 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -33.92 -46.18 0.22 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.104 0.478 . . . . 0.0 110.571 179.826 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.569 ' HD2' ' N3 ' ' A' ' 18' ' ' ' A' . 9.5 ttp85 -60.44 -45.85 92.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.004 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.2 OUTLIER -60.17 -53.15 61.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.0 -179.244 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.492 HD13 ' HA ' ' B' ' 428' ' ' ALA . 0.3 OUTLIER -56.74 -64.13 0.97 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -178.448 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.504 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.3 m-85 -78.26 -52.09 9.17 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -177.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.572 ' OG ' " O2'" ' A' ' 18' ' ' ' A' . 1.3 t -69.05 -29.15 67.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.49 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.9 OUTLIER -102.89 -35.53 8.56 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.665 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.454 HG13 HD21 ' B' ' 438' ' ' LEU . 8.1 mm -136.01 37.44 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.504 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -121.61 81.13 0.34 Allowed Glycine 0 CA--C 1.517 0.207 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.8 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.631 ' CE2' ' CD1' ' B' ' 383' ' ' LEU . 36.1 p90 -105.11 174.37 5.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.887 0.375 . . . . 0.0 110.812 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -80.07 82.17 6.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.15 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.508 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 0.6 OUTLIER 160.71 -31.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.162 179.792 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.631 ' CD1' ' CE2' ' B' ' 380' ' ' TYR . 0.2 OUTLIER -54.21 -54.97 32.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.925 0.393 . . . . 0.0 110.468 179.784 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' B' ' 385' ' ' LEU . 5.4 tpt180 76.28 46.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.414 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.499 ' HA ' HG12 ' B' ' 406' ' ' VAL . 3.0 mt -38.82 140.22 0.38 Allowed 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -140.8 89.27 2.25 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -177.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.565 ' CZ ' ' SG ' ' B' ' 404' ' ' CYS . 39.7 m-85 -91.87 122.76 34.7 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 177.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -114.83 118.16 57.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.396 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 8.4 m -83.81 110.16 18.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.657 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.54 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 35.9 m -115.92 149.93 18.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.16 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.54 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 88.68 58.54 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.077 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.438 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER -38.13 142.89 0.44 Allowed Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.507 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' B' ' 392' ' ' LYS . 7.0 Cg_exo -71.37 158.76 53.5 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.181 1.921 . . . . 0.0 113.019 -178.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 34.8 p -129.62 161.02 31.51 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.355 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -85.32 14.26 5.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.563 179.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' B' ' 397' ' ' ASP . 4.7 m -136.89 9.26 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.886 178.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' B' ' 396' ' ' VAL . 0.2 OUTLIER 168.7 62.94 0.01 OUTLIER Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.785 -179.483 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.502 ' HB3' " C4'" ' A' ' 5' ' ' ' U' . 1.6 Cg_endo -42.08 -35.71 3.44 Favored 'Trans proline' 0 N--CA 1.464 -0.225 0 C-N-CA 123.687 2.925 . . . . 0.0 112.572 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.523 ' O ' ' ND2' ' B' ' 399' ' ' ASN . 1.2 p-10 -29.01 121.12 0.13 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.041 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 400' ' ' SER . . . . . 0.401 ' O ' HG23 ' B' ' 416' ' ' VAL . 1.3 t -131.42 162.5 30.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.053 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.491 HD11 ' OG1' ' B' ' 414' ' ' THR . 0.0 OUTLIER -120.42 155.87 23.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.963 0.411 . . . . 0.0 111.501 -179.423 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.484 ' O ' HD11 ' B' ' 401' ' ' ILE . 0.1 OUTLIER -126.45 139.73 50.84 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.831 -179.591 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -102.26 119.86 39.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.939 0.399 . . . . 0.0 110.476 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.565 ' SG ' ' CZ ' ' B' ' 387' ' ' TYR . 5.6 t -92.22 95.35 9.67 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.489 ' HA ' ' O ' ' B' ' 410' ' ' THR . 35.3 ttp180 -129.16 162.27 28.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.461 -178.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.499 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -139.64 144.56 28.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.074 -179.657 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 55.97 14.0 7.36 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.298 -0.953 . . . . 0.0 111.296 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 13.1 t70 57.51 23.01 8.67 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 120.801 0.334 . . . . 0.0 110.288 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -139.96 -0.71 1.92 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.238 -0.982 . . . . 0.0 113.703 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.489 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 23.3 m -142.83 117.59 9.87 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 117.237 0.518 . . . . 0.0 111.759 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.475 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 73.4 t -95.55 108.51 21.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.589 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.556 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.4 OUTLIER -63.06 -37.2 86.24 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.85 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 175.21 -139.93 5.01 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.213 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.491 ' OG1' HD11 ' B' ' 401' ' ' ILE . 3.0 t -170.12 168.48 8.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.684 0.278 . . . . 0.0 110.854 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.465 ' HA3' ' CG ' ' B' ' 426' ' ' ARG . . . -159.99 131.84 2.8 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.497 -0.858 . . . . 0.0 112.424 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.452 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 7.7 p -119.15 146.05 24.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.528 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -154.53 144.37 11.08 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.057 -1.068 . . . . 0.0 112.992 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.476 ' N ' HD12 ' B' ' 422' ' ' ILE . 5.5 ptm180 -57.01 -45.87 82.73 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.846 0.355 . . . . 0.0 111.69 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.629 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.0 OUTLIER -99.34 29.41 3.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.274 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.567 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.5 OUTLIER 50.74 -45.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 179.133 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.629 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -45.24 -56.73 4.55 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 118.884 0.765 . . . . 0.0 109.247 179.884 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.576 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -42.01 -33.77 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 177.882 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.567 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -67.82 -48.62 65.72 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.047 -0.979 . . . . 0.0 109.781 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -60.9 -58.8 11.9 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 119.866 -1.159 . . . . 0.0 111.345 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . . . . . . . . . 3.4 mp -56.27 -39.55 60.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.503 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.576 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.8 tpt180 -61.84 -52.31 64.69 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.342 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.485 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -45.6 -42.01 10.7 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.539 ' HB1' ' CB ' ' B' ' 370' ' ' ALA . . . -60.28 -58.18 9.62 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.521 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.581 ' O ' ' CD2' ' B' ' 432' ' ' LEU . 2.9 tm-20 -52.92 -17.18 1.28 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.552 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.485 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 1.4 m-80 -81.02 -38.92 26.66 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.096 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.471 ' O ' ' HE3' ' B' ' 437' ' ' MET . . . -62.61 -45.26 93.68 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.916 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.581 ' CD2' ' O ' ' B' ' 429' ' ' GLU . 0.1 OUTLIER -83.29 1.86 38.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.756 179.455 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 0.2 OUTLIER -78.83 6.94 7.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.213 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.55 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 84.4 m-20 -130.12 83.76 2.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.89 0.376 . . . . 0.0 111.379 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.579 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.2 OUTLIER -48.27 -53.97 15.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.514 179.682 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.579 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 3.5 mmpt? -54.4 -42.21 70.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.555 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.55 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 0.3 OUTLIER -70.59 -34.55 72.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.805 179.21 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.46 HD13 ' HA ' ' B' ' 432' ' ' LEU . 7.2 mt -65.62 -63.96 0.97 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -54.79 -26.9 37.67 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.474 ' HB3' ' O ' ' B' ' 437' ' ' MET . 2.7 t80 -61.55 -44.0 97.83 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.499 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.4 ' CE2' ' HG2' ' B' ' 437' ' ' MET . 49.7 m-85 -69.86 -26.67 64.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.18 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -59.69 -48.77 80.34 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -63.36 -41.93 98.87 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.768 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.445 ' O ' HG21 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -62.48 -34.5 76.96 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.115 0.483 . . . . 0.0 109.808 178.857 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.613 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -57.41 -57.82 11.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.005 179.144 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -63.74 -26.08 68.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.297 179.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' B' ' 449' ' ' PRO . . . -74.79 -76.46 0.14 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.353 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.463 ' C ' ' O ' ' B' ' 447' ' ' ALA . 1.1 pt -24.89 87.26 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.998 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . 0.501 ' N ' ' O ' ' B' ' 447' ' ' ALA . 74.2 Cg_exo -51.21 -18.55 5.09 Favored 'Trans proline' 0 C--O 1.23 0.109 0 C-N-CA 123.013 2.475 . . . . 0.0 112.765 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . 0.468 ' O ' ' OG ' ' B' ' 451' ' ' SER . 0.3 OUTLIER 52.76 76.02 0.21 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.8 0.333 . . . . 0.0 110.347 -179.811 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 451' ' ' SER . . . . . 0.468 ' OG ' ' O ' ' B' ' 450' ' ' ARG . 60.4 p 60.08 -153.44 0.38 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.611 -179.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -156.25 22.43 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.815 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 17.9 p . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.916 -179.99 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 1.008 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.433 1.597 0 C5'-C4'-C3' 110.958 -3.028 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 1.008 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.281 0 O4'-C1'-N19 111.25 3.05 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.635 " O2'" " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.533 0 C5'-C4'-C3' 111.044 -2.97 . 0.466 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 1.013 " O2'" " H5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.098 0 O4'-C1'-N19 111.503 3.303 . 0.167 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 1.013 " H5'" " O2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.191 0 O4'-C1'-N19 111.093 2.893 . 0.362 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.603 " H5'" " O2'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 C3'-C2'-C1' 104.301 3.113 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.57 " C5'" HO2' ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.839 0 O4'-C1'-N19 111.335 3.135 . 0.086 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.627 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.284 0 O4'-C1'-N19 111.246 3.046 . 0.159 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.627 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.421 0 O4'-C1'-N19 111.033 2.833 . 0.275 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.545 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.431 -1.871 0 C5'-C4'-C3' 111.172 -2.885 . 0.03 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.612 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.437 0 O4'-C1'-N19 111.333 3.133 . 0.024 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.928 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.907 0 C5'-C4'-C3' 111.351 -2.766 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.928 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.668 0 C3'-C2'-C1' 104.578 3.42 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.769 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.539 0 C5'-C4'-C3' 111.162 -2.892 . 0.13 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.979 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -2.012 0 C5'-C4'-C3' 110.888 -3.075 . 0.01 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.979 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.138 0 O4'-C1'-N19 111.631 3.431 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.498 " O2'" " O4'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.089 0 C5'-C4'-C3' 110.843 -3.105 OUTLIER-DELTA 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.628 ' H61' " C2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.884 0 C5'-C4'-C3' 110.879 -3.08 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.467 ' H22' ' CD ' ' B' ' 371' ' ' LYS . . . . . . . . 0 O4'--C1' 1.44 2.13 0 C5'-C4'-C3' 111.107 -2.929 . 0.026 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.797 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.764 0 C5'-C4'-C3' 110.982 -3.012 . 0.15 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.786 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.449 0 C5'-C4'-C3' 110.896 -3.069 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.925 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.613 1.974 0 O4'-C1'-N19 111.174 2.974 . 0.018 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.722 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.109 0 O4'-C1'-N19 111.905 3.705 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.749 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.176 0 C5'-C4'-C3' 111.483 -2.678 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.439 " H5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.127 0 O4'-C1'-N19 111.463 3.263 . 0.209 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.515 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.466 0 O4'-C1'-N19 111.235 3.035 . 0.127 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.616 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.17 0 O4'-C1'-N19 111.06 2.86 . 0.108 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.642 " O2'" " C5'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.61 0 C3'-C2'-C1' 104.677 3.53 . 0.035 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.696 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.265 0 O4'-C1'-N19 111.26 3.06 . 0.169 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.946 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.443 2.397 0 O4'-C1'-N19 111.334 3.134 . 0.083 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.946 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.384 0 O4'-C1'-N19 111.454 3.254 . 0.226 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.551 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.521 0 C5'-C4'-C3' 111.199 -2.867 . 0.437 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.197 0 N-CA-C 112.582 -0.207 . . . . 0.0 112.582 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 365' ' ' SER . . . . . 0.45 ' O ' ' C ' ' B' ' 366' ' ' LEU . 4.5 t -81.71 61.36 5.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.752 0.31 . . . . 0.0 110.902 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.523 ' O ' ' C ' ' B' ' 367' ' ' ASP . 0.1 OUTLIER -28.69 -45.74 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.751 -179.699 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.523 ' C ' ' O ' ' B' ' 366' ' ' LEU . 0.5 OUTLIER -15.84 -58.07 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 O-C-N 123.742 0.651 . . . . 0.0 111.703 -179.609 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.472 ' O ' ' HG3' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -44.36 -62.36 1.2 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.017 179.23 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.514 ' N ' ' O ' ' B' ' 366' ' ' LEU . 0.2 OUTLIER -53.23 -32.95 50.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.37 179.114 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.487 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -58.0 -81.56 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.463 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -37.33 -44.82 0.63 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.129 0.49 . . . . 0.0 110.175 179.519 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.543 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.7 OUTLIER -57.26 -47.32 81.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.47 179.343 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.487 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -57.71 -44.15 85.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.147 0.498 . . . . 0.0 111.159 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.523 ' CD2' HD12 ' B' ' 432' ' ' LEU . 0.6 OUTLIER -59.16 -70.13 0.17 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -178.393 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.456 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.0 m-85 -83.36 -32.34 26.28 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -177.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -81.56 -24.79 36.32 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -178.913 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.476 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 2.4 mm? -117.3 -18.96 9.78 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.469 ' O ' HD12 ' B' ' 385' ' ' LEU . 1.6 mm -144.12 44.99 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.832 0.349 . . . . 0.0 111.342 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.456 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -165.43 60.56 0.24 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.692 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.574 ' CD1' ' HD3' ' B' ' 445' ' ' ARG . 22.3 p90 -63.45 -56.98 11.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.776 0.322 . . . . 0.0 110.512 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.432 ' HB1' ' O ' ' B' ' 380' ' ' TYR . . . 166.7 31.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.986 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.403 ' CB ' ' CE2' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -169.81 28.85 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.856 0.36 . . . . 0.0 110.981 179.806 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.574 ' O ' ' N ' ' B' ' 385' ' ' LEU . 0.2 OUTLIER -108.12 20.34 18.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.459 179.803 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.458 ' HB3' ' HA3' ' B' ' 407' ' ' GLY . 0.6 OUTLIER 26.49 37.58 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 O-C-N 123.786 0.679 . . . . 0.0 111.689 179.597 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.574 ' N ' ' O ' ' B' ' 383' ' ' LEU . 0.5 OUTLIER -67.17 130.86 44.45 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.948 0.404 . . . . 0.0 110.544 -179.805 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.577 ' O ' ' CD2' ' B' ' 386' ' ' HIS . 5.4 p-80 -167.7 133.23 1.97 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.316 0.579 . . . . 0.0 112.194 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.572 ' CE2' ' SG ' ' B' ' 404' ' ' CYS . 34.4 m-85 -85.71 -177.25 6.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.033 178.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.503 HG22 ' O ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -160.42 111.51 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.3 0.572 . . . . 0.0 111.358 178.286 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.9 m -74.61 116.13 14.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.954 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.496 ' O ' HG23 ' B' ' 401' ' ' ILE . 23.9 m -126.1 151.16 32.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.582 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.468 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 79.42 49.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.474 -179.673 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.442 ' C ' ' O ' ' B' ' 391' ' ' LYS . 36.1 mttt -32.3 127.33 0.35 Allowed Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.11 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.497 ' C ' ' CG2' ' B' ' 394' ' ' THR . 12.3 Cg_endo -56.8 -170.77 0.03 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.723 2.282 . . . . 0.0 112.064 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.497 ' CG2' ' C ' ' B' ' 393' ' ' PRO . 0.1 OUTLIER -168.33 168.3 11.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.001 -179.906 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -71.6 -10.22 59.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.923 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.485 HG22 ' OG1' ' B' ' 394' ' ' THR . 33.5 m -128.28 12.87 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 CA-C-O 121.378 0.609 . . . . 0.0 110.104 178.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.558 ' N ' ' HD3' ' B' ' 398' ' ' PRO . 0.2 OUTLIER -164.24 56.68 0.52 Allowed Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.913 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.558 ' HD3' ' N ' ' B' ' 397' ' ' ASP . 50.2 Cg_exo -53.75 -19.19 14.01 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.093 2.529 . . . . 0.0 113.166 -179.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.559 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 43.9 p-10 -65.09 139.57 58.73 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 121.301 0.572 . . . . 0.0 111.474 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 400' ' ' SER . . . . . 0.548 ' O ' ' HA ' ' B' ' 416' ' ' VAL . 17.6 t -137.41 161.08 37.28 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.771 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.496 HG23 ' O ' ' B' ' 390' ' ' VAL . 4.8 tp -128.79 113.04 27.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 121.18 0.514 . . . . 0.0 111.243 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.471 ' O ' HG23 ' B' ' 414' ' ' THR . 1.9 t -79.3 164.31 3.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.846 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.503 ' O ' HG22 ' B' ' 388' ' ' VAL . 1.3 mm-40 -133.23 106.36 7.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.174 0.511 . . . . 0.0 110.812 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.572 ' SG ' ' CE2' ' B' ' 387' ' ' TYR . 2.0 t -85.9 108.59 18.23 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.476 ' O ' ' O ' ' B' ' 386' ' ' HIS . 0.0 OUTLIER -140.26 151.7 45.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.072 0.463 . . . . 0.0 111.375 -179.379 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.573 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -123.35 126.78 73.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.512 -179.248 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . 0.458 ' HA3' ' HB3' ' B' ' 384' ' ' ARG . . . -28.52 -35.67 0.01 OUTLIER Glycine 0 C--N 1.331 0.277 0 CA-C-N 115.652 -0.704 . . . . 0.0 113.758 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' B' ' 406' ' ' VAL . 58.9 t0 -53.36 -20.98 5.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.231 0.539 . . . . 0.0 110.151 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 101.8 42.88 2.2 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.081 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.458 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 13.9 m -137.79 133.24 33.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.921 0.391 . . . . 0.0 111.774 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.488 ' HA ' ' O ' ' B' ' 404' ' ' CYS . 42.9 t -94.63 88.13 2.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.61 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.483 ' CB ' ' HE1' ' B' ' 437' ' ' MET . 0.1 OUTLIER -51.47 -13.63 0.24 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.316 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.413 ' N ' ' HB3' ' B' ' 404' ' ' CYS . . . 153.51 -165.65 31.5 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 119.62 -1.276 . . . . 0.0 113.39 178.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.471 HG23 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -142.27 173.77 11.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.75 0.31 . . . . 0.0 110.563 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.526 ' HA2' ' CG ' ' B' ' 426' ' ' ARG . . . -146.61 98.9 0.2 Allowed Glycine 0 C--O 1.225 -0.416 0 C-N-CA 120.324 -0.941 . . . . 0.0 112.626 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.548 ' HA ' ' O ' ' B' ' 400' ' ' SER . 13.5 p -105.45 157.46 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.893 0.347 . . . . 0.0 110.193 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.559 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . 166.63 138.13 2.37 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 119.422 -1.37 . . . . 0.0 113.496 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.508 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.1 OUTLIER -47.09 -67.41 0.28 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.005 0.431 . . . . 0.0 109.957 179.403 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.784 ' O ' ' N ' ' B' ' 421' ' ' LYS . 2.1 p-10 -85.01 91.81 8.18 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 176.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.532 ' O ' ' CB ' ' B' ' 423' ' ' ALA . 0.9 OUTLIER -17.74 -31.5 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -177.411 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.784 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.6 OUTLIER -44.83 -57.05 3.99 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.831 179.011 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.578 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.2 OUTLIER -44.98 -39.44 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.569 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.579 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.532 ' CB ' ' O ' ' B' ' 420' ' ' ILE . . . -63.35 -37.6 87.9 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.827 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -70.31 -65.48 2.51 Favored Glycine 0 C--N 1.334 0.45 0 C-N-CA 120.206 -0.997 . . . . 0.0 111.724 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . . . . . . . . . 3.1 mp -53.76 -35.39 26.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.228 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.578 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 1.7 tpt180 -61.59 -53.27 58.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.002 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.53 ' HB2' ' CE2' ' B' ' 387' ' ' TYR . . . -45.51 -45.88 13.57 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.916 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.499 ' O ' ' N ' ' B' ' 431' ' ' ALA . . . -56.54 -72.39 0.08 Allowed 'General case' 0 C--O 1.238 0.467 0 CA-C-O 121.147 0.499 . . . . 0.0 110.216 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.514 ' O ' HD22 ' B' ' 432' ' ' LEU . 19.9 mt-10 -45.61 -25.77 0.51 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.026 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.489 ' ND2' ' HD2' ' B' ' 426' ' ' ARG . 1.3 m-80 -72.33 -34.22 67.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.218 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.499 ' N ' ' O ' ' B' ' 428' ' ' ALA . . . -65.83 -43.96 86.98 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.451 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.523 HD12 ' CD2' ' B' ' 374' ' ' LEU . 0.0 OUTLIER -101.42 25.93 7.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.021 0.439 . . . . 0.0 110.645 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 20.3 ttt180 -94.4 -9.84 34.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.07 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.408 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 3.6 m-20 -109.29 95.13 5.42 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.786 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.538 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 2.5 ptmt -56.33 -31.64 63.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.5 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.538 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 5.9 mtpt -66.15 -54.86 20.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.525 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.487 ' CE ' ' O ' ' B' ' 431' ' ' ALA . 17.5 tmm? -63.86 -46.94 82.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.299 179.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.522 ' CD2' ' HA ' ' B' ' 432' ' ' LEU . 71.4 mt -55.24 -59.05 5.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.961 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -64.49 -24.68 67.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.678 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.602 ' CE2' ' CZ ' ' B' ' 441' ' ' TYR . 0.1 OUTLIER -62.28 -47.29 84.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.134 0.493 . . . . 0.0 109.783 179.561 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.602 ' CZ ' ' CE2' ' B' ' 440' ' ' PHE . 64.9 m-85 -76.94 -41.51 42.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.153 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -44.01 -45.19 7.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.97 -45.67 66.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.288 178.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.516 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -52.32 -24.52 7.66 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.652 178.86 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.574 ' HD3' ' CD1' ' B' ' 380' ' ' TYR . 0.2 OUTLIER -79.18 -66.07 0.92 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.04 -179.846 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -45.8 -25.95 0.59 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.432 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . -78.94 -53.07 7.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.861 0.362 . . . . 0.0 111.187 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.516 HG12 ' HA ' ' B' ' 445' ' ' ARG . 2.9 pt -52.74 129.81 46.37 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.35 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -68.37 -176.26 1.07 Allowed 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.735 2.29 . . . . 0.0 112.389 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -139.73 80.58 1.78 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.918 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 1.3 m -130.71 -47.98 1.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.858 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.41 94.22 8.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.88 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 57.7 p . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.875 -179.918 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.871 " O5'" ' H8 ' ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.663 0 O4'-C1'-N19 111.262 3.062 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.538 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.349 0 O4'-C1'-N19 111.307 3.107 . 0.208 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.661 HO2' " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.706 0 C3'-C2'-C1' 104.29 3.1 . 0.102 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.661 " C5'" HO2' ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.238 0 O4'-C1'-N19 111.171 2.971 . 0.124 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.619 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.088 0 O4'-C1'-N19 111.063 2.863 . 0.184 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.465 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.279 0 O4'-C1'-N19 111.057 2.857 . 0.096 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.682 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.14 0 O4'-C1'-N19 111.256 3.056 . 0.18 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.693 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.254 0 O4'-C1'-N19 111.133 2.933 . 0.355 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.693 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 C5'-C4'-C3' 111.122 -2.919 . 0.075 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.64 " O2'" " C5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.437 1.927 0 C5'-C4'-C3' 111.12 -2.92 . 0.123 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.64 " C5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.635 0 C5'-C4'-C3' 110.926 -3.049 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.664 " O2'" " C5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.003 0 O4'-C1'-N19 111.348 3.148 . 0.113 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.684 " O2'" " H5'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.28 0 O4'-C1'-N19 111.649 3.449 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.684 " H5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.429 -1.993 0 C5'-C4'-C3' 111.054 -2.964 . 0.027 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.842 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.251 0 C5'-C4'-C3' 110.971 -3.02 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.842 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -2.017 0 O4'-C1'-N19 111.948 3.748 OUTLIER-DELTA 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.494 " O2'" " C1'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.083 0 C5'-C4'-C3' 110.964 -3.024 OUTLIER-DELTA 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.647 " H2'" " O4'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.435 1.715 0 O4'-C1'-N19 111.207 3.007 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.647 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.832 0 O4'-C1'-N19 111.199 2.999 . 0.022 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.786 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.943 0 C5'-C4'-C3' 110.872 -3.085 OUTLIER-DELTA 0.0 OUTLIER '7D dist &a' 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.655 HO2' " C5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.611 1.817 0 O4'-C1'-N19 111.302 3.102 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.842 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.011 0 C5'-C4'-C3' 111.055 -2.963 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.682 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.314 0 O4'-C1'-N19 111.875 3.675 . 0.089 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.811 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.249 0 C5'-C4'-C3' 111.437 -2.709 . 0.068 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.645 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.345 0 O4'-C1'-N19 111.436 3.236 . 0.397 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.645 ' C6 ' ' C6 ' ' A' ' 25' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.281 0 O4'-C1'-N19 111.505 3.305 . 0.102 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.704 ' H6 ' " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.005 0 C5'-C4'-C3' 111.138 -2.908 . 0.231 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.643 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.582 0 C3'-C2'-C1' 104.829 3.699 . 0.011 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.732 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.106 0 O4'-C1'-N19 110.985 2.785 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 1.051 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.195 0 O4'-C1'-N19 111.525 3.325 . 0.287 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 1.051 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.604 0 O4'-C1'-N19 111.373 3.173 . 0.193 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.457 " O5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.396 0 O4'-C1'-N19 111.199 2.999 . 0.209 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' B' ' 366' ' ' LEU . . . . . . . . 0 N--CA 1.487 2.093 0 N-CA-C 112.604 -0.198 . . . . 0.0 112.604 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.65 80.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.797 0.332 . . . . 0.0 110.604 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.505 ' N ' ' O ' ' B' ' 364' ' ' GLY . 11.6 tp -135.0 124.84 25.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.98 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.5 OUTLIER -55.73 -63.3 1.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.174 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.468 ' HA ' ' NZ ' ' B' ' 371' ' ' LYS . 2.1 ttp -36.2 -52.67 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.355 179.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.432 ' HB2' ' HB3' ' B' ' 366' ' ' LEU . 1.0 OUTLIER -61.46 -42.0 98.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.161 179.387 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.527 ' HB3' ' CB ' ' B' ' 428' ' ' ALA . . . -65.41 -83.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.943 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.511 ' HE2' ' N3 ' ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -26.67 -49.91 0.04 OUTLIER 'General case' 0 C--O 1.235 0.301 0 O-C-N 123.428 0.455 . . . . 0.0 111.053 179.769 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.492 ' O ' ' HB2' ' B' ' 376' ' ' SER . 35.7 ttp85 -54.08 -61.97 1.96 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.359 179.168 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.54 ' HA ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -47.61 -54.53 11.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 111.09 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.448 HD11 ' OH ' ' B' ' 387' ' ' TYR . 7.7 mt -42.86 -67.85 0.24 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -178.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.523 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-30 -93.16 -48.3 6.53 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.601 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.492 ' HB2' ' O ' ' B' ' 372' ' ' ARG . 11.9 m -60.61 -13.94 17.37 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 121.259 -0.176 . . . . 0.0 111.338 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.54 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.9 OUTLIER -125.43 -29.12 3.26 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.235 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.458 HG21 HD11 ' B' ' 383' ' ' LEU . 6.8 mm -142.88 44.2 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -178.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.523 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -142.48 74.77 0.33 Allowed Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.719 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.539 ' OH ' ' CG ' ' B' ' 444' ' ' GLN . 0.1 OUTLIER -100.41 -76.67 0.55 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.745 0.307 . . . . 0.0 110.803 179.876 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . 168.1 82.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.008 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 25.1 t 176.58 -69.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.618 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.477 HD13 ' HB2' ' B' ' 385' ' ' LEU . 1.6 pt? -41.99 -28.15 0.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.822 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' B' ' 407' ' ' GLY . 0.7 OUTLIER 62.93 53.27 2.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.748 -179.721 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.536 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 6.1 tt -76.7 127.6 33.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.664 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.502 ' N ' HD22 ' B' ' 385' ' ' LEU . 14.3 p-80 -152.07 140.83 20.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.52 0.676 . . . . 0.0 112.366 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.499 ' CZ ' ' SG ' ' B' ' 404' ' ' CYS . 40.5 m-85 -91.89 160.65 15.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.869 179.347 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.55 HG21 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -136.97 138.25 46.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.118 179.067 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 389' ' ' THR . . . . . 0.525 ' O ' ' CG2' ' B' ' 389' ' ' THR . 0.4 OUTLIER -100.08 113.49 26.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.708 -179.786 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.478 ' O ' HG21 ' B' ' 401' ' ' ILE . 32.0 m -122.52 147.37 26.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.413 0.625 . . . . 0.0 111.42 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.539 ' CB ' HG22 ' B' ' 401' ' ' ILE . 9.3 tmtt? 80.55 55.97 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.961 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.444 ' C ' ' O ' ' B' ' 391' ' ' LYS . 2.8 mmtt -34.55 142.69 0.23 Allowed Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.672 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.565 ' HB2' " O2'" ' A' ' 5' ' ' ' U' . 14.6 Cg_exo -65.67 162.95 32.18 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.214 1.943 . . . . 0.0 111.845 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 22.8 p -132.29 158.99 40.43 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.855 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -82.01 7.66 12.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.517 179.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.465 ' O ' ' OD1' ' B' ' 397' ' ' ASP . 20.5 m -128.67 -15.72 2.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.313 178.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.465 ' OD1' ' O ' ' B' ' 396' ' ' VAL . 1.3 m-20 -158.83 65.41 2.88 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.543 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.453 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 74.7 Cg_exo -40.86 -40.31 3.56 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 123.607 2.871 . . . . 0.0 114.092 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.505 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 3.0 p-10 -33.74 140.7 0.05 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.049 0.452 . . . . 0.0 111.502 -178.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 2.7 m -143.23 163.0 34.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.466 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.539 HG22 ' CB ' ' B' ' 391' ' ' LYS . 0.5 OUTLIER -123.74 140.92 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 121.211 0.529 . . . . 0.0 111.557 -179.273 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.53 ' CG2' ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -102.84 179.3 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.121 179.479 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.55 ' CB ' HG21 ' B' ' 388' ' ' VAL . 0.1 OUTLIER -149.97 108.38 3.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.024 0.44 . . . . 0.0 110.531 178.902 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.521 ' O ' HG12 ' B' ' 411' ' ' VAL . 1.8 t -82.55 116.88 22.17 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.569 ' HA ' ' O ' ' B' ' 410' ' ' THR . 2.5 ptm180 -152.16 172.32 16.54 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.416 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.536 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 3.7 m -139.86 138.37 38.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.895 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' B' ' 384' ' ' ARG . . . -35.66 -36.83 0.12 Allowed Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 116.105 -0.498 . . . . 0.0 113.326 -179.26 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -55.55 -17.51 5.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.046 0.45 . . . . 0.0 110.382 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 95.66 45.81 2.85 Favored Glycine 0 N--CA 1.445 -0.718 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.625 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.569 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 37.4 m -131.55 112.59 12.76 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 -179.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.521 HG12 ' O ' ' B' ' 404' ' ' CYS . 30.4 t -84.43 86.64 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.416 179.006 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.52 HD23 ' CG1' ' B' ' 406' ' ' VAL . 0.0 OUTLIER -46.36 -23.1 0.31 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.98 -179.528 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.27 -154.51 25.4 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.042 -1.075 . . . . 0.0 113.383 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.481 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 3.3 m -155.99 154.64 31.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.73 -0.235 . . . . 0.0 110.472 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.539 ' O ' ' CD1' ' B' ' 401' ' ' ILE . . . -139.94 160.81 26.28 Favored Glycine 0 C--O 1.224 -0.523 0 C-N-CA 119.691 -1.242 . . . . 0.0 113.981 -179.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 1.4 p -146.52 145.57 19.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.505 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -161.69 132.71 2.92 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.061 -1.066 . . . . 0.0 113.246 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.514 ' N ' HD13 ' B' ' 422' ' ' ILE . 6.6 ttm180 -54.33 -53.58 51.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.948 0.404 . . . . 0.0 110.896 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.562 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.1 OUTLIER -79.48 -15.88 57.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.136 179.343 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.562 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 93.23 -42.69 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.159 0 C-N-CA 123.434 0.693 . . . . 0.0 111.536 -179.514 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.562 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.1 OUTLIER -52.63 -45.89 66.82 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.01 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.598 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -52.95 -36.58 24.17 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.691 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 177.648 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.53 ' O ' ' CG2' ' B' ' 402' ' ' VAL . . . -66.75 -43.4 84.23 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.556 178.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.87 -64.95 3.3 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.258 -0.972 . . . . 0.0 111.144 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . . . . . . . . . 53.6 mt -52.97 -41.54 41.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.852 0.358 . . . . 0.0 110.471 179.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.598 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 6.4 tpt180 -57.66 -55.86 29.37 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.497 ' HA ' ' OD1' ' B' ' 430' ' ' ASN . . . -40.81 -44.88 2.34 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.527 ' CB ' ' HB3' ' B' ' 370' ' ' ALA . . . -53.04 -62.96 1.31 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.648 178.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.483 ' HA ' HD11 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -48.29 -31.83 6.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.35 179.117 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.497 ' OD1' ' HA ' ' B' ' 427' ' ' ALA . 9.1 m120 -67.56 -31.69 71.93 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.785 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.495 ' HB2' ' OH ' ' B' ' 387' ' ' TYR . . . -70.96 -48.26 54.38 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.763 0.316 . . . . 0.0 110.643 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.55 ' C ' ' CD2' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -89.94 14.38 12.31 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.756 179.486 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . 0.53 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 8.6 ttt-85 -86.08 3.28 43.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.426 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.493 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 3.7 t70 -126.5 92.39 3.55 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.115 0.484 . . . . 0.0 111.011 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.541 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -55.86 -32.88 64.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.668 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.541 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 15.6 mtmm -66.92 -59.22 3.7 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.518 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.519 ' SD ' ' CD1' ' B' ' 412' ' ' LEU . 0.9 OUTLIER -55.53 -51.78 65.89 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.286 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.543 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 96.0 mt -53.58 -65.65 0.53 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 178.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -42.09 -37.56 1.44 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.366 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.533 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -63.81 -42.77 97.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.633 179.439 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.526 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 50.4 m-85 -71.91 -35.8 69.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.262 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.72 -48.37 63.62 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -38.59 90.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.628 178.479 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.539 ' CG ' ' OH ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -64.96 -23.16 67.14 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.233 179.516 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.533 ' O ' ' CG1' ' B' ' 448' ' ' ILE . 13.7 tpt180 -86.79 -28.57 22.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.143 -179.293 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -88.09 -41.33 13.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.924 0.392 . . . . 0.0 110.845 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.451 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -61.96 -46.92 87.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.08 -179.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.533 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 0.7 OUTLIER -30.33 105.22 0.22 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.602 -179.801 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -47.08 164.92 0.1 Allowed 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.843 2.362 . . . . 0.0 112.358 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -155.29 83.22 1.06 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.83 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 451' ' ' SER . . . . . 0.43 ' O ' ' O ' ' B' ' 452' ' ' GLU . 0.3 OUTLIER 67.84 171.84 0.27 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.773 -179.809 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . 0.526 ' O ' ' CB ' ' B' ' 453' ' ' SER . 0.0 OUTLIER 60.03 139.89 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.67 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 453' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' B' ' 452' ' ' GLU . 3.4 p . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.905 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.857 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.435 1.741 0 O4'-C1'-N19 111.323 3.123 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.857 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.308 0 O4'-C1'-N19 111.308 3.108 . 0.125 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.584 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.745 0 C3'-C2'-C1' 104.917 3.797 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.584 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.262 0 O4'-C1'-N19 111.18 2.98 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.575 " O5'" " O2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.098 0 O4'-C1'-N19 111.137 2.937 . 0.159 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.449 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.293 0 O4'-C1'-N19 111.462 3.262 . 0.129 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.671 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.904 0 C5'-C4'-C3' 111.122 -2.918 . 0.182 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.567 ' N4 ' ' N4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.359 0 O4'-C1'-N19 111.469 3.269 . 0.158 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.664 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.263 0 O4'-C1'-N19 111.124 2.924 . 0.163 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.664 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.455 0 O4'-C1'-N19 111.229 3.029 . 0.126 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.635 " C5'" HO2' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.406 0 C5'-C4'-C3' 111.349 -2.768 . 0.047 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.735 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.014 0 O4'-C1'-N19 111.477 3.277 . 0.06 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.735 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.155 0 O4'-C1'-N19 111.294 3.094 . 0.089 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.512 ' N4 ' ' C4 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.0 0 O4'-C1'-N19 111.044 2.844 . 0.503 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.836 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 P--O5' 1.611 1.83 0 C5'-C4'-C3' 111.038 -2.975 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.836 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.22 0 C5'-C4'-C3' 110.904 -3.064 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.682 " O2'" ' N9 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.366 0 C5'-C4'-C3' 111.047 -2.969 OUTLIER-EPSILON 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.682 ' N9 ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 1.961 0 C5'-C4'-C3' 111.036 -2.976 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.455 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.306 0 C5'-C4'-C3' 111.209 -2.861 . 0.068 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.631 " O2'" " C5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.742 0 O4'-C1'-N19 111.333 3.133 . 0.037 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.644 " O2'" " C5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.991 0 O4'-C1'-N19 111.296 3.096 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.843 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.922 0 O4'-C1'-N19 111.235 3.035 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.824 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.186 0 C5'-C4'-C3' 111.199 -2.868 . 0.031 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.806 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.555 0 C3'-C2'-C1' 104.873 3.747 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.501 ' P ' HO2' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.359 0 O4'-C1'-N19 111.167 2.967 . 0.054 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.592 HO2' " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.611 0 C3'-C2'-C1' 104.333 3.147 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.592 " C5'" HO2' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.127 0 O4'-C1'-N19 111.222 3.022 . 0.137 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.605 " O2'" " O5'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.436 0 C3'-C2'-C1' 104.068 2.853 . 0.09 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.605 " O5'" " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.133 0 O4'-C1'-N19 111.064 2.864 . 0.17 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.782 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.326 0 O4'-C1'-N19 111.271 3.071 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.799 " O2'" " H5'" ' A' ' 32' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.396 0 O4'-C1'-N19 111.437 3.237 . 0.411 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.799 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.508 0 C5'-C4'-C3' 111.269 -2.82 . 0.578 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.159 0 N-CA-C 112.435 -0.266 . . . . 0.0 112.435 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 365' ' ' SER . . . . . 0.461 ' O ' ' HG3' ' B' ' 368' ' ' MET . 0.3 OUTLIER -132.5 36.03 3.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.957 0.408 . . . . 0.0 110.813 179.744 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.474 HD11 ' O ' ' B' ' 366' ' ' LEU . 0.0 OUTLIER -46.17 -20.42 0.1 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.846 -0.616 . . . . 0.0 112.046 -179.617 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.467 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.5 OUTLIER -42.63 -70.94 0.09 Allowed 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.033 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.486 ' HA ' ' HD2' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -29.94 -65.06 0.11 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.947 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.459 ' OD1' ' HE2' ' B' ' 368' ' ' MET . 2.9 m120 -42.27 -49.22 5.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.798 0.332 . . . . 0.0 110.486 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.467 ' N ' ' O ' ' B' ' 367' ' ' ASP . . . -58.95 -79.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.42 179.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.486 ' HD2' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -36.22 -40.97 0.24 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.086 0.47 . . . . 0.0 110.17 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.539 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.2 tmm_? -59.4 -63.52 1.27 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.278 179.221 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.524 ' HG3' ' CB ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -45.56 -34.98 3.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.394 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.517 ' CD2' HD22 ' B' ' 432' ' ' LEU . 1.3 mt -68.44 -76.73 0.09 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.494 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.9 m-30 -84.91 21.58 1.56 Allowed 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.118 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -131.02 -36.7 1.32 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.731 0.3 . . . . 0.0 111.04 179.706 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 2.1 mp -102.89 -27.55 12.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.161 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.548 HG13 ' CD2' ' B' ' 438' ' ' LEU . 3.6 mm -139.91 37.43 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.134 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.444 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.494 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -126.52 93.36 0.4 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.351 -0.928 . . . . 0.0 112.909 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.464 ' CD2' ' HG2' ' B' ' 445' ' ' ARG . 42.8 p90 -105.43 -169.72 1.64 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.712 0.292 . . . . 0.0 110.291 179.335 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.613 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -87.19 109.41 19.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.26 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.613 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 10.7 t 104.1 37.26 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.755 0.66 . . . . 0.0 111.782 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.541 ' CD1' ' O ' ' B' ' 378' ' ' ILE . 2.8 tt -87.43 -49.43 7.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.11 0.481 . . . . 0.0 110.056 179.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.472 ' HB3' ' HA3' ' B' ' 407' ' ' GLY . 0.0 OUTLIER 72.08 35.7 1.24 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.406 178.758 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.573 HD21 ' CD1' ' B' ' 387' ' ' TYR . 0.3 OUTLIER -40.21 140.8 0.56 Allowed 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.617 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.556 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 1.4 t60 -128.24 83.31 2.15 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 -178.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.591 ' CE1' ' SG ' ' B' ' 404' ' ' CYS . 3.9 m-85 -83.84 116.98 23.0 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.104 177.275 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.82 113.78 44.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.9 0.381 . . . . 0.0 111.074 -179.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 54.3 m -77.37 127.92 33.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.348 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.489 HG23 ' CG2' ' B' ' 401' ' ' ILE . 31.8 m -134.6 151.54 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.097 0.475 . . . . 0.0 111.448 -179.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' B' ' 390' ' ' VAL . 10.7 tppt? 83.31 54.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.952 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.442 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER -34.95 142.83 0.24 Allowed Pre-proline 0 C--N 1.332 -0.153 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.415 179.842 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.566 ' HB2' " O2'" ' A' ' 5' ' ' ' U' . 2.7 Cg_exo -74.3 155.54 46.36 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 122.34 2.027 . . . . 0.0 113.434 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.461 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 1.7 p -138.69 165.96 25.61 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.507 -1.224 . . . . 0.0 111.762 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . 0.538 ' O ' " O2'" ' A' ' 30' ' ' ' C' . . . -86.89 12.9 9.99 Favored 'General case' 0 CA--C 1.527 0.088 0 CA-C-O 121.33 0.586 . . . . 0.0 110.276 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 3.7 m -138.52 18.91 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.507 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.43 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 0.8 OUTLIER 162.77 55.82 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.28 -179.538 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.513 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 3.9 Cg_endo -46.52 -48.79 13.0 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 123.623 2.882 . . . . 0.0 112.745 -179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.558 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -32.57 130.28 0.18 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.028 -178.814 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 13.8 m -132.58 159.51 39.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.392 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.489 ' CG2' HG23 ' B' ' 390' ' ' VAL . 16.8 tt -117.32 164.79 13.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.962 0.41 . . . . 0.0 111.221 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.507 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.2 OUTLIER -135.69 138.67 47.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.013 -179.001 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.49 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 6.5 mt-10 -101.35 126.15 48.07 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.591 ' SG ' ' CE1' ' B' ' 387' ' ' TYR . 19.0 t -109.03 102.35 11.34 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.556 ' O ' ' CB ' ' B' ' 386' ' ' HIS . 17.9 ptt180 -143.45 111.47 6.12 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.352 0.596 . . . . 0.0 111.485 -178.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.527 HG13 ' CD2' ' B' ' 383' ' ' LEU . 10.2 m -59.05 150.3 5.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.597 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . 0.472 ' HA3' ' HB3' ' B' ' 384' ' ' ARG . . . -52.5 -15.72 3.13 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.003 -0.999 . . . . 0.0 113.908 -179.129 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.14 -2.92 14.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.794 0.33 . . . . 0.0 110.564 179.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 86.74 41.79 6.66 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.618 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.536 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 21.5 m -140.72 125.37 17.95 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.803 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.499 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 54.9 t -87.46 112.58 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.309 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' B' ' 404' ' ' CYS . 1.2 mm? -67.75 -41.02 84.03 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . -177.42 -149.05 7.61 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.573 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.494 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -151.08 173.94 13.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.733 0.301 . . . . 0.0 110.906 -179.803 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.475 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -162.09 122.65 1.12 Allowed Glycine 0 C--O 1.227 -0.327 0 C-N-CA 120.186 -1.007 . . . . 0.0 113.066 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.464 ' HA ' ' HB1' ' B' ' 423' ' ' ALA . 6.4 p -126.67 149.42 31.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.805 0.336 . . . . 0.0 110.606 179.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.558 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -163.5 158.08 30.42 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.024 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.459 ' N ' HD12 ' B' ' 422' ' ' ILE . 8.8 ptt180 -63.2 -42.26 99.28 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.624 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.9 OUTLIER -101.46 30.15 4.41 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 179.418 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.555 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.55 -43.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 115.37 1.618 . . . . 0.0 115.37 178.402 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.624 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -48.91 -47.29 43.49 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.711 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.596 ' N ' ' CD ' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -49.45 -38.34 12.33 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.541 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.555 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -61.92 -48.32 80.98 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.627 178.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.425 ' HA2' HG22 ' B' ' 402' ' ' VAL . . . -63.33 -65.36 3.13 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.319 -0.943 . . . . 0.0 111.404 179.042 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.509 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 0.8 OUTLIER -50.37 -32.76 9.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.893 0.377 . . . . 0.0 109.994 178.925 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.593 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 27.6 tpt180 -65.46 -48.07 73.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.929 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.507 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -48.91 -42.1 35.83 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.425 ' CB ' ' HB3' ' B' ' 370' ' ' ALA . . . -58.07 -60.1 4.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.707 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.469 ' OE2' HD11 ' B' ' 366' ' ' LEU . 14.6 mm-40 -48.73 -33.09 9.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.012 179.143 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.494 ' ND2' ' O ' ' B' ' 414' ' ' THR . 1.2 m-80 -65.02 -39.08 92.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.289 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.503 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -62.33 -41.75 98.81 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.156 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.524 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -87.33 0.37 55.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.795 179.414 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . 0.465 ' O ' ' HG2' ' B' ' 433' ' ' ARG . 54.8 ttt-85 -88.28 16.45 6.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.977 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -129.21 76.54 1.73 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.131 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.49 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -51.4 -32.54 26.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.097 0.475 . . . . 0.0 109.87 179.524 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.49 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -69.82 -42.37 73.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.092 179.642 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.411 ' SD ' ' CE1' ' B' ' 441' ' ' TYR . 13.2 tmm? -76.89 -44.73 30.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.027 179.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.548 ' CD2' HG13 ' B' ' 378' ' ' ILE . 68.1 mt -52.84 -67.69 0.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -53.36 -42.66 67.08 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.681 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.478 ' CB ' ' O ' ' B' ' 436' ' ' LYS . 2.5 t80 -53.7 -32.52 52.19 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.494 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 3.7 m-85 -78.7 -30.37 46.01 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.03 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -52.87 -39.52 62.69 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 177.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.15 -42.09 60.49 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.248 177.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.494 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -63.21 -13.8 41.73 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.406 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.543 ' O ' ' CG1' ' B' ' 448' ' ' ILE . 0.0 OUTLIER -90.41 -46.35 8.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.665 -179.877 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -69.28 -36.22 76.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.129 0.49 . . . . 0.0 109.933 179.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.474 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -74.94 -80.1 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.477 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.543 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 0.2 OUTLIER 27.14 94.69 0.04 OUTLIER Pre-proline 0 N--CA 1.463 0.188 0 CA-C-O 121.197 0.522 . . . . 0.0 111.601 -179.328 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . 0.438 ' O ' ' HB2' ' B' ' 450' ' ' ARG . 63.0 Cg_endo -87.11 -17.57 3.0 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 123.185 2.59 . . . . 0.0 112.623 -179.471 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' B' ' 449' ' ' PRO . 0.0 OUTLIER 74.15 31.93 1.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.862 -179.845 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 66.2 m -110.91 176.69 4.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.919 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -127.23 120.42 28.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.923 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.84 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.941 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.67 0 O4'-C1'-N19 111.175 2.975 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.941 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.244 0 O4'-C1'-N19 111.359 3.159 . 0.182 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.585 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.593 0 C3'-C2'-C1' 104.644 3.494 . 0.069 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.585 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.063 0 O4'-C1'-N19 111.202 3.002 . 0.167 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.843 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.021 0 C5'-C4'-C3' 111.407 -2.728 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.99 " O2'" " H5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.428 -2.113 0 O4'-C1'-N19 111.341 3.141 . 0.263 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.99 " H5'" " O2'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.91 0 C5'-C4'-C3' 111.073 -2.951 . 0.119 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.711 ' N4 ' ' N4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.529 0 O4'-C1'-N19 111.421 3.221 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.878 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.122 0 C5'-C4'-C3' 111.366 -2.756 . 0.112 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.878 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 C3'-C2'-C1' 104.67 3.522 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.636 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.576 0 C5'-C4'-C3' 111.294 -2.804 . 0.014 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.809 ' H6 ' " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.435 1.756 0 C5'-C4'-C3' 110.961 -3.026 . 0.019 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.771 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.607 0 C3'-C2'-C1' 104.636 3.485 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.67 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.381 0 C5'-C4'-C3' 111.186 -2.876 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.67 " O4'" " H2'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.165 0 C5'-C4'-C3' 110.976 -3.016 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.652 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.899 0 O4'-C1'-N19 111.275 3.075 OUTLIER-EPSILON 0.067 1b . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.61 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -2.013 0 C5'-C4'-C3' 111.053 -2.965 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.583 ' N3 ' ' HG3' ' B' ' 372' ' ' ARG . . . . . . . . 0 P--O5' 1.611 1.759 0 C5'-C4'-C3' 110.996 -3.003 . 0.01 2a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.484 " O4'" " O2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.943 0 O4'-C1'-N19 111.043 2.843 . 0.197 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.843 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.862 0 C5'-C4'-C3' 110.928 -3.048 . 0.016 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.824 " O4'" " H2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.341 0 C3'-C2'-C1' 104.375 3.194 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.911 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.611 1.809 0 O4'-C1'-N19 111.213 3.013 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.744 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.159 0 O4'-C1'-N19 111.263 3.063 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.744 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.618 0 C3'-C2'-C1' 104.801 3.668 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.596 " O5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.249 0 O4'-C1'-N19 111.252 3.052 . 0.046 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.487 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.6 0 O4'-C1'-N19 111.019 2.819 . 0.094 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.773 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.125 0 O4'-C1'-N19 110.99 2.79 . 0.143 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.773 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.589 0 C3'-C2'-C1' 104.782 3.647 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.754 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.227 0 O4'-C1'-N19 111.019 2.819 . 0.155 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.913 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.269 0 O4'-C1'-N19 111.44 3.24 . 0.208 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.913 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.461 0 O4'-C1'-N19 111.412 3.212 . 0.237 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.603 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.408 0 C5'-C4'-C3' 111.104 -2.931 . 0.578 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.07 0 N-CA-C 112.467 -0.253 . . . . 0.0 112.467 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 365' ' ' SER . . . . . 0.423 ' OG ' ' O ' ' B' ' 365' ' ' SER . 2.0 t 43.84 67.7 0.63 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.846 0.355 . . . . 0.0 111.08 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.463 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 0.1 OUTLIER -74.53 -174.11 1.97 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.973 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.547 ' OD1' ' N ' ' B' ' 367' ' ' ASP . 0.2 OUTLIER -42.11 -71.5 0.08 Allowed 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.323 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.498 ' N ' ' HE2' ' B' ' 371' ' ' LYS . 10.8 ptm -34.74 -43.14 0.17 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.407 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' B' ' 366' ' ' LEU . 6.2 m-80 -64.08 -49.85 70.66 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.024 0.44 . . . . 0.0 109.83 179.096 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.525 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -53.73 -78.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.107 179.042 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.498 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -32.5 -50.69 0.25 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.091 -179.587 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.583 ' HG3' ' N3 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -51.96 -45.42 64.4 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.413 179.766 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.535 ' HG3' ' CB ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -58.93 -52.08 67.27 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.366 0.603 . . . . 0.0 110.898 179.775 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.521 ' CD2' HD22 ' B' ' 432' ' ' LEU . 1.5 mt -53.68 -73.85 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -82.65 -33.67 27.73 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.541 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -82.1 -16.38 50.18 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.111 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.522 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.4 OUTLIER -120.19 -24.77 5.87 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.357 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.522 ' O ' ' N ' ' B' ' 380' ' ' TYR . 27.7 mm -124.13 -65.83 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 C-N-CA 120.796 -0.362 . . . . 0.0 111.949 -179.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' B' ' 374' ' ' LEU . . . -56.29 79.06 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.459 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.543 ' O ' ' CB ' ' B' ' 381' ' ' ALA . 2.5 p90 -60.55 -41.46 94.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.498 0.19 . . . . 0.0 111.169 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.543 ' CB ' ' O ' ' B' ' 380' ' ' TYR . . . 154.99 -20.3 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.893 0.378 . . . . 0.0 111.169 179.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 1.7 m -127.29 39.62 3.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.69 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.542 HD11 ' CE1' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -99.2 -36.3 9.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.068 -179.858 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 76.52 48.27 0.07 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.051 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.552 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 9.6 tt -89.39 143.11 27.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.56 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 14.3 p-80 -164.12 138.27 5.57 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.481 0.658 . . . . 0.0 112.576 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.486 ' HA ' ' O ' ' B' ' 403' ' ' GLU . 15.2 m-85 -98.48 142.14 30.46 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.077 178.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.517 ' O ' ' N ' ' B' ' 390' ' ' VAL . 0.1 OUTLIER -122.29 116.72 49.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.896 -179.793 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 389' ' ' THR . . . . . 0.407 ' O ' HG22 ' B' ' 389' ' ' THR . 18.2 m -60.0 85.99 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 177.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.587 ' CG1' HG23 ' B' ' 401' ' ' ILE . 1.6 p -83.43 132.15 32.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.25 -0.887 . . . . 0.0 111.448 -177.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.537 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.9 OUTLIER 90.88 132.88 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.546 -178.348 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.463 ' N ' ' HD3' ' B' ' 391' ' ' LYS . 1.5 mmmm -85.56 123.06 73.19 Favored Pre-proline 0 N--CA 1.464 0.244 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.343 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.465 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 2.9 Cg_exo -74.64 164.07 34.53 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.979 2.453 . . . . 0.0 113.357 -179.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -107.74 -158.74 0.66 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.342 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -89.13 -48.53 7.33 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.551 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.545 HG23 " O2'" ' A' ' 30' ' ' ' C' . 2.7 m -111.74 -13.1 11.38 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-O 121.658 0.742 . . . . 0.0 110.266 179.161 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.564 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 0.8 OUTLIER -115.44 44.95 0.39 Allowed Pre-proline 0 C--N 1.318 -0.776 0 CA-C-N 114.53 -1.213 . . . . 0.0 110.966 179.888 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' B' ' 397' ' ' ASP . 13.7 Cg_exo -45.67 -22.21 1.09 Allowed 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.533 2.156 . . . . 0.0 112.062 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' B' ' 398' ' ' PRO . 0.2 OUTLIER -20.26 88.64 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.295 0 O-C-N 123.665 0.603 . . . . 0.0 111.233 179.997 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 400' ' ' SER . . . . . 0.479 ' N ' ' O ' ' B' ' 398' ' ' PRO . 18.0 t -119.21 159.87 23.23 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.283 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.587 HG23 ' CG1' ' B' ' 390' ' ' VAL . 13.6 tt -112.26 160.61 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-O 121.476 0.655 . . . . 0.0 111.003 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.484 ' O ' ' OG1' ' B' ' 414' ' ' THR . 0.4 OUTLIER -120.25 142.04 37.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.786 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.566 ' N ' HG13 ' B' ' 390' ' ' VAL . 0.3 OUTLIER -106.11 121.33 43.94 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.461 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.565 ' O ' ' N ' ' B' ' 412' ' ' LEU . 2.6 m -101.76 105.93 16.87 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.495 ' HA ' ' HA ' ' B' ' 411' ' ' VAL . 1.6 ptm180 -138.01 -179.94 6.07 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.364 0.602 . . . . 0.0 112.357 -178.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.552 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -148.63 139.75 17.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.02 -179.431 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . 0.465 ' O ' ' CG ' ' B' ' 408' ' ' ASP . . . 56.29 16.29 14.06 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.15 -1.024 . . . . 0.0 110.737 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . 0.47 ' O ' ' OD1' ' B' ' 408' ' ' ASP . 1.9 p30 55.29 32.98 19.74 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.226 0.536 . . . . 0.0 110.336 -179.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -140.26 -26.64 0.23 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.517 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.479 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 44.6 m -121.24 110.92 16.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 117.143 0.471 . . . . 0.0 112.226 -179.234 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.495 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 60.1 t -86.53 111.63 21.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.336 178.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.565 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.3 OUTLIER -66.85 -37.74 85.03 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.248 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . -178.67 -143.44 5.25 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.452 -0.88 . . . . 0.0 112.408 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.523 ' OG1' ' CD1' ' B' ' 401' ' ' ILE . 11.5 t -176.1 170.1 2.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.557 0.218 . . . . 0.0 110.886 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.478 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -161.18 146.43 12.29 Favored Glycine 0 C--O 1.226 -0.398 0 C-N-CA 120.348 -0.929 . . . . 0.0 112.804 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.472 ' CG2' ' HB ' ' B' ' 401' ' ' ILE . 54.7 t -121.34 155.05 25.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.813 0.339 . . . . 0.0 110.704 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.549 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -165.05 141.32 6.97 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.128 -1.034 . . . . 0.0 113.117 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.471 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -63.62 -41.54 98.27 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.722 0.296 . . . . 0.0 111.047 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.604 ' O ' ' N ' ' B' ' 421' ' ' LYS . 8.6 p30 -102.47 29.68 5.09 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.509 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.538 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 47.81 -44.42 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 178.629 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.604 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -48.37 -48.95 36.31 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 119.116 0.871 . . . . 0.0 108.676 -179.398 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.593 ' N ' ' CD ' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -47.52 -38.21 5.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.533 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -66.29 -43.2 86.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.493 178.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.48 -67.25 2.14 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.774 -0.727 . . . . 0.0 111.978 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.446 HG21 ' CG ' ' B' ' 367' ' ' ASP . 5.0 mm -50.25 -59.38 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.825 0.345 . . . . 0.0 111.205 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.564 ' HG3' ' N ' ' B' ' 427' ' ' ALA . 0.0 OUTLIER -49.36 -44.47 44.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.21 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.564 ' N ' ' HG3' ' B' ' 426' ' ' ARG . . . -47.4 -51.67 19.11 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.457 ' HA ' ' OH ' ' B' ' 387' ' ' TYR . . . -52.22 -50.9 61.04 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.828 179.15 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.495 ' HA ' ' CG ' ' B' ' 432' ' ' LEU . 40.2 mt-10 -56.22 -34.16 66.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.882 179.023 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.445 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.4 OUTLIER -59.91 -41.06 90.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.461 179.344 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.456 ' HB2' ' OH ' ' B' ' 387' ' ' TYR . . . -64.13 -42.55 96.77 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.234 0.54 . . . . 0.0 110.295 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.535 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -84.26 7.03 20.54 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.482 179.328 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 10.0 mtt180 -94.86 14.3 21.95 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.084 0.468 . . . . 0.0 110.969 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.534 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 67.4 m-20 -125.73 78.27 1.73 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.821 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.553 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 8.6 ptpt -46.85 -53.55 11.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.047 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.553 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.3 mttt -55.65 -40.54 72.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 0.0 110.695 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.534 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 0.1 OUTLIER -71.91 -46.7 56.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.317 179.546 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.432 ' CD2' HG13 ' B' ' 378' ' ' ILE . 72.2 mt -57.95 -61.69 2.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.002 179.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -54.27 -33.23 58.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.906 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.462 ' HB3' ' O ' ' B' ' 437' ' ' MET . 5.8 t80 -59.21 -38.57 80.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.493 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.469 ' HA ' ' HB2' ' B' ' 444' ' ' GLN . 53.2 m-85 -79.42 -27.2 41.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.112 179.029 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -59.66 -52.48 65.35 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.9 -47.17 86.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 177.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.469 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -59.82 -17.01 32.76 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.15 178.591 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.501 ' O ' HG12 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -78.73 -48.41 14.97 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.343 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -75.22 -30.4 60.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.562 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.468 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -73.12 -79.99 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.239 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.501 HG12 ' O ' ' B' ' 445' ' ' ARG . 0.2 OUTLIER 28.22 94.8 0.04 OUTLIER Pre-proline 0 N--CA 1.463 0.225 0 CA-C-O 121.146 0.498 . . . . 0.0 111.489 -179.533 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . 0.423 ' O ' ' CB ' ' B' ' 450' ' ' ARG . 83.0 Cg_endo -79.23 -5.8 14.52 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.986 2.458 . . . . 0.0 112.72 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . 0.423 ' CB ' ' O ' ' B' ' 449' ' ' PRO . 0.0 OUTLIER 77.29 101.72 0.07 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.684 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 80.4 p -167.15 56.01 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.059 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -111.72 13.64 21.12 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.902 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.978 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.717 " O2'" ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.637 0 C3'-C2'-C1' 104.787 3.653 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.717 ' H8 ' " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.272 0 O4'-C1'-N19 111.206 3.006 . 0.035 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.505 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.495 0 C5'-C4'-C3' 111.02 -2.987 . 0.101 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.505 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.125 0 C5'-C4'-C3' 111.127 -2.915 . 0.074 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.641 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 P--O5' 1.613 2.026 0 O4'-C1'-N19 111.183 2.983 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.535 " O2'" " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.365 0 C5'-C4'-C3' 111.118 -2.921 . 0.1 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.712 ' N4 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 P--O5' 1.611 1.827 0 C5'-C4'-C3' 111.139 -2.908 . 0.06 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.712 ' N4 ' ' N4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.563 0 C3'-C2'-C1' 104.554 3.393 . 0.195 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.995 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.168 0 O4'-C1'-N19 111.015 2.815 . 0.128 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.995 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.711 0 C3'-C2'-C1' 104.615 3.461 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.643 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.486 0 C5'-C4'-C3' 111.171 -2.886 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.803 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.803 0 C5'-C4'-C3' 111.152 -2.899 . 0.039 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.803 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.525 0 C3'-C2'-C1' 104.634 3.482 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.665 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.407 0 C5'-C4'-C3' 111.158 -2.895 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.847 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 1.96 0 C5'-C4'-C3' 110.934 -3.044 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.847 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.158 0 O4'-C1'-N19 111.275 3.075 OUTLIER-EPSILON 0.0 OUTLIER '7D dist 1b' 0.0 . . . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.774 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.95 0 C5'-C4'-C3' 110.701 -3.199 OUTLIER-EPSILON 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.697 ' P ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.926 0 C5'-C4'-C3' 111.093 -2.938 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.546 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.296 0 C5'-C4'-C3' 111.053 -2.964 . 0.344 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.792 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.807 0 O4'-C1'-N19 111.183 2.983 . 0.257 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.792 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.519 0 C5'-C4'-C3' 111.073 -2.951 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.698 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.875 0 O4'-C1'-N19 111.176 2.976 . 0.054 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.914 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.182 0 O4'-C1'-N19 111.217 3.017 . 0.018 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.914 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.438 0 C3'-C2'-C1' 104.431 3.257 . 0.234 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.567 " C5'" HO2' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.308 0 O4'-C1'-N19 111.171 2.971 . 0.243 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.439 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.563 0 O4'-C1'-N19 111.094 2.894 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.974 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.081 0 O4'-C1'-N19 111.029 2.829 . 0.232 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.974 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.376 0 C3'-C2'-C1' 104.633 3.481 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.693 " H2'" " O4'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.286 0 O4'-C1'-N19 111.151 2.951 . 0.105 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.999 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.273 0 O4'-C1'-N19 111.46 3.26 . 0.126 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.999 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.876 0 C3'-C2'-C1' 104.574 3.415 . 0.071 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.447 " O5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.54 0 O4'-C1'-N19 111.161 2.961 . 0.175 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . 0.416 ' O ' ' HB3' ' B' ' 365' ' ' SER . . . . . . . . 0 N--CA 1.489 2.196 0 N-CA-C 112.374 -0.291 . . . . 0.0 112.374 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 365' ' ' SER . . . . . 0.456 ' O ' ' N ' ' B' ' 367' ' ' ASP . 20.7 t 70.76 25.34 4.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.916 0.389 . . . . 0.0 110.81 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.536 ' O ' ' N ' ' B' ' 369' ' ' ASN . 0.1 OUTLIER -36.12 -32.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.112 -179.904 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.483 ' C ' ' O ' ' B' ' 366' ' ' LEU . 3.4 p30 -30.14 -37.7 0.02 OUTLIER 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.965 -179.029 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.51 ' N ' ' O ' ' B' ' 366' ' ' LEU . 0.0 OUTLIER -54.37 -55.16 31.34 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.824 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.536 ' N ' ' O ' ' B' ' 366' ' ' LEU . 16.1 m120 -55.18 -37.74 67.44 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.459 ' HA ' ' CD2' ' B' ' 432' ' ' LEU . . . -49.87 -78.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.746 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.463 ' HD3' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -41.68 -42.16 2.45 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.33 0.586 . . . . 0.0 109.939 179.606 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.583 ' HG3' ' N3 ' ' A' ' 18' ' ' ' A' . 13.7 ttp180 -55.64 -46.82 77.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.484 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.551 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -57.29 -47.07 82.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.437 0.637 . . . . 0.0 110.49 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.481 ' N ' ' CD2' ' B' ' 374' ' ' LEU . 1.3 mt -51.63 -70.57 0.08 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.58 -179.029 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.431 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.3 m-85 -84.97 -42.08 15.27 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -177.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.9 OUTLIER -65.41 -29.3 69.98 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.551 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 4.3 mm? -110.94 -44.58 3.59 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.886 -179.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.55 HG13 ' CD2' ' B' ' 438' ' ' LEU . 0.9 OUTLIER -118.45 51.59 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.983 0.421 . . . . 0.0 111.432 -179.185 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.431 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -140.22 44.6 1.05 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.219 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.627 ' CD1' ' N ' ' B' ' 381' ' ' ALA . 23.5 p90 -91.03 -45.93 8.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.678 0.275 . . . . 0.0 111.169 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.627 ' N ' ' CD1' ' B' ' 380' ' ' TYR . . . 160.85 -168.0 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.266 0.555 . . . . 0.0 111.638 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 5.7 t 43.91 22.27 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.562 -0.745 . . . . 0.0 112.083 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.529 ' O ' HG12 ' B' ' 406' ' ' VAL . 2.0 pt? -127.39 -0.49 6.3 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.469 ' HB2' ' HA2' ' B' ' 407' ' ' GLY . 1.3 mmt180 29.95 49.48 0.06 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.344 179.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.571 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 0.4 OUTLIER -59.94 129.76 43.39 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 121.073 0.464 . . . . 0.0 111.411 -179.505 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.581 ' O ' ' CD2' ' B' ' 386' ' ' HIS . 24.0 p-80 -167.79 108.88 0.59 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.154 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.487 ' CE2' ' HB3' ' B' ' 427' ' ' ALA . 2.8 m-85 -55.76 175.55 0.08 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.149 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.42 ' N ' ' O ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -157.54 101.87 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.743 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 31.4 m -77.18 106.32 8.83 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.661 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.549 ' CG2' ' O ' ' B' ' 401' ' ' ILE . 28.4 m -112.42 150.43 14.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 0.0 110.678 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.58 ' CB ' ' CG2' ' B' ' 401' ' ' ILE . 8.2 tppt? 72.44 48.97 0.22 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.38 -179.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' B' ' 391' ' ' LYS . 2.2 mtmt -33.79 143.64 0.18 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.194 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.566 ' HB2' " O2'" ' A' ' 5' ' ' ' U' . 32.3 Cg_exo -58.23 179.98 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.954 2.436 . . . . 0.0 112.499 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.532 ' OG1' ' N ' ' B' ' 397' ' ' ASP . 0.1 OUTLIER -160.84 155.42 23.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.089 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -59.24 -23.27 62.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.138 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.463 ' CG1' " O2'" ' A' ' 30' ' ' ' C' . 2.8 m -123.96 13.44 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.234 0.54 . . . . 0.0 110.264 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.532 ' N ' ' OG1' ' B' ' 394' ' ' THR . 0.8 OUTLIER -157.51 51.96 0.53 Allowed Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.468 179.645 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.525 ' HD3' ' N ' ' B' ' 397' ' ' ASP . 85.4 Cg_exo -46.65 -29.02 7.14 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.788 2.325 . . . . 0.0 112.396 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.484 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 20.8 p-10 -53.27 132.0 38.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.258 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -135.37 144.33 46.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.123 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.58 ' CG2' ' CB ' ' B' ' 391' ' ' LYS . 0.6 OUTLIER -107.29 100.17 10.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-O 121.213 0.53 . . . . 0.0 111.223 -179.463 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.516 ' CG2' ' O ' ' B' ' 423' ' ' ALA . 0.4 OUTLIER -72.39 163.2 4.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.048 179.716 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.499 ' HG2' ' N ' ' B' ' 404' ' ' CYS . 44.9 tt0 -148.9 158.49 44.21 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.79 ' O ' ' O ' ' B' ' 411' ' ' VAL . 24.3 t -132.49 130.72 40.83 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 178.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -129.79 126.99 39.43 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 123.697 0.623 . . . . 0.0 110.776 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.571 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -124.64 134.23 67.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.516 -179.287 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . 0.469 ' HA2' ' HB2' ' B' ' 384' ' ' ARG . . . 64.18 5.78 17.06 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.754 -0.736 . . . . 0.0 111.866 -179.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 66.48 68.61 0.43 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 163.87 -46.51 0.31 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.113 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.486 ' CG2' ' CD1' ' B' ' 412' ' ' LEU . 12.0 m -86.78 113.47 22.64 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.79 ' O ' ' O ' ' B' ' 404' ' ' CYS . 3.9 t -76.6 -60.93 1.91 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 -177.026 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.553 ' CD2' HG22 ' B' ' 406' ' ' VAL . 0.1 OUTLIER 63.9 -39.2 0.21 Allowed 'General case' 0 C--N 1.315 -0.893 0 O-C-N 120.144 -1.598 . . . . 0.0 111.569 -178.51 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.557 ' HA3' ' CB ' ' B' ' 404' ' ' CYS . . . -112.97 127.5 7.97 Favored Glycine 0 C--N 1.35 1.326 0 C-N-CA 119.511 -1.328 . . . . 0.0 113.774 -179.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.523 ' N ' ' OD1' ' B' ' 430' ' ' ASN . 0.2 OUTLIER -165.84 63.16 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.709 0.29 . . . . 0.0 111.295 179.431 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.55 ' O ' ' CD1' ' B' ' 401' ' ' ILE . . . -109.82 172.81 16.18 Favored Glycine 0 C--O 1.226 -0.368 0 C-N-CA 120.407 -0.901 . . . . 0.0 113.667 -178.411 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 5.7 p -131.96 166.76 28.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.583 0.23 . . . . 0.0 110.628 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.484 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -172.81 116.25 0.6 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.092 -1.052 . . . . 0.0 113.184 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.543 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -43.69 -68.2 0.22 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.713 0.292 . . . . 0.0 110.386 179.324 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.616 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.2 OUTLIER -66.6 -20.57 66.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.039 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.616 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 1.1 pp 102.29 -39.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 124.387 1.075 . . . . 0.0 111.37 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -49.63 -52.04 33.49 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.75 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.576 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -47.49 -33.27 2.96 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.519 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 177.417 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.523 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -74.22 -34.44 63.69 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.478 179.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -70.58 -56.24 7.71 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.149 -1.024 . . . . 0.0 111.152 178.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . . . . . . . . . 3.5 mp -63.77 -42.93 97.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.729 0.299 . . . . 0.0 110.446 179.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.576 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 17.8 tpt180 -53.51 -53.01 57.59 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.521 ' O ' ' CB ' ' B' ' 430' ' ' ASN . . . -51.57 -40.23 59.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.509 ' O ' ' N ' ' B' ' 431' ' ' ALA . . . -52.49 -74.21 0.04 OUTLIER 'General case' 0 C--O 1.236 0.393 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.539 ' HA ' ' CD2' ' B' ' 432' ' ' LEU . 3.3 mt-10 -43.04 -36.28 1.55 Allowed 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.551 ' HB3' ' HA2' ' B' ' 413' ' ' GLY . 0.3 OUTLIER -53.2 -36.86 61.42 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.263 178.954 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.552 ' O ' ' CE ' ' B' ' 437' ' ' MET . . . -83.51 -18.96 36.67 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 120.911 0.386 . . . . 0.0 110.782 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.539 ' CD2' ' HA ' ' B' ' 429' ' ' GLU . 0.8 OUTLIER -115.81 21.58 13.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.177 0.513 . . . . 0.0 109.965 178.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' B' ' 429' ' ' GLU . 38.0 mtt-85 -109.63 3.15 20.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.043 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.446 ' OD2' ' HA ' ' B' ' 412' ' ' LEU . 43.8 m-20 -106.37 77.07 1.18 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.303 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.523 ' HG3' ' N ' ' B' ' 436' ' ' LYS . 5.5 ptpp? -38.89 -48.08 1.51 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.558 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.523 ' N ' ' HG3' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -57.57 -51.56 68.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.043 -179.716 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.552 ' CE ' ' O ' ' B' ' 431' ' ' ALA . 15.4 tmm? -61.43 -56.59 18.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.146 0.498 . . . . 0.0 110.0 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.55 ' CD2' HG13 ' B' ' 378' ' ' ILE . 60.4 mt -47.81 -64.77 0.7 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.882 178.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -54.92 -25.22 27.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.465 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.471 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -69.83 -39.08 76.67 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.362 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.532 ' HA ' ' HB2' ' B' ' 444' ' ' GLN . 32.4 m-85 -76.01 -51.97 11.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.174 179.118 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' B' ' 445' ' ' ARG . . . -44.45 -46.31 9.56 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -40.06 91.59 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.532 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -68.64 -7.18 30.77 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.49 178.917 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.593 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.1 OUTLIER -95.71 -40.08 9.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.411 179.98 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.87 -25.07 58.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.722 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . -76.15 -50.83 13.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.656 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.507 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 8.1 pt -45.93 139.94 5.06 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.115 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -79.39 8.23 4.02 Favored 'Trans proline' 0 N--CA 1.465 -0.206 0 C-N-CA 122.93 2.42 . . . . 0.0 112.371 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 4.6 mtt-85 -123.34 61.39 1.05 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.013 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.29 -12.77 14.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.674 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.19 50.39 1.74 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.887 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 5.0 t . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.203 -0.904 . . . . 0.0 111.065 179.955 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.743 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.955 0 O4'-C1'-N19 111.539 3.339 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.743 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 1.979 0 C5'-C4'-C3' 111.382 -2.745 . 0.17 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.584 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.604 0 C3'-C2'-C1' 104.662 3.513 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.584 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.2 0 O4'-C1'-N19 111.287 3.087 . 0.07 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.759 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 1.991 0 C5'-C4'-C3' 111.291 -2.806 . 0.056 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.517 " H5'" " O2'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.606 0 C5'-C4'-C3' 111.044 -2.97 . 0.139 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.431 " H5'" " O2'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.008 0 O4'-C1'-N19 111.49 3.29 . 0.308 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.72 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.209 0 O4'-C1'-N19 110.917 2.717 . 0.237 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.72 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.383 0 O4'-C1'-N19 111.178 2.978 . 0.254 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.693 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.435 1.772 0 C5'-C4'-C3' 110.976 -3.016 . 0.047 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.616 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.477 0 O4'-C1'-N19 111.028 2.828 . 0.041 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.832 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.757 0 O4'-C1'-N19 111.064 2.864 . 0.103 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.832 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.663 0 C3'-C2'-C1' 104.55 3.389 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.73 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.544 0 O4'-C1'-N19 111.087 2.887 . 0.072 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.73 " O4'" " H2'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.428 -2.073 0 O4'-C1'-N19 111.113 2.913 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.64 ' C8 ' ' C6 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -1.989 0 O4'-C1'-N19 111.315 3.115 OUTLIER-EPSILON 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.624 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -2.003 0 C5'-C4'-C3' 110.797 -3.135 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.63 ' N6 ' " O2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.883 0 C5'-C4'-C3' 111.206 -2.863 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.547 " O2'" " O4'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.113 0 O4'-C1'-N19 111.2 3.0 . 0.225 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.553 " O2'" ' HG2' ' B' ' 371' ' ' LYS . . . . . . . . 0 O4'--C1' 1.439 2.062 0 C5'-C4'-C3' 111.074 -2.95 . 0.109 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.538 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 C3'-C2'-C1' 104.331 3.146 . 0.034 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.799 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.895 0 O4'-C1'-N19 111.096 2.896 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.687 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.276 0 O4'-C1'-N19 111.943 3.743 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.846 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.157 0 C5'-C4'-C3' 111.318 -2.788 . 0.062 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.497 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.109 0 O4'-C1'-N19 111.065 2.865 . 0.425 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.514 " O2'" " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.432 0 O4'-C1'-N19 111.135 2.935 . 0.355 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.564 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.132 0 O4'-C1'-N19 111.03 2.83 . 0.128 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.633 " O2'" " C5'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.267 0 C5'-C4'-C3' 111.072 -2.952 . 0.125 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.939 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.205 0 O4'-C1'-N19 111.041 2.841 . 0.199 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.939 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.366 0 O4'-C1'-N19 111.325 3.125 . 0.19 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.682 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.679 0 C3'-C2'-C1' 104.704 3.56 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.655 " C5'" HO2' ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.664 0 O4'-C1'-N19 111.336 3.136 . 0.051 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.222 0 N-CA-C 112.578 -0.209 . . . . 0.0 112.578 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 365' ' ' SER . . . . . 0.439 ' C ' HD22 ' B' ' 366' ' ' LEU . 58.0 p -170.8 52.0 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.835 0.35 . . . . 0.0 110.943 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.552 ' O ' ' N ' ' B' ' 369' ' ' ASN . 2.7 mt -116.16 -37.84 3.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.573 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.501 ' C ' ' O ' ' B' ' 366' ' ' LEU . 0.0 OUTLIER -20.59 -60.49 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.246 -179.047 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.569 ' CE ' ' HB3' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -48.14 -48.95 33.86 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.981 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.569 ' HB3' ' CE ' ' B' ' 368' ' ' MET . 0.5 OUTLIER -66.12 -25.72 67.12 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 178.786 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.473 ' HA ' HD23 ' B' ' 432' ' ' LEU . . . -58.99 -70.7 0.14 Allowed 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.553 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 0.1 OUTLIER -48.74 -33.27 9.91 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.317 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.548 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -58.88 -46.64 87.33 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.867 -1.061 . . . . 0.0 109.959 178.839 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.512 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -63.02 -45.54 91.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.497 -179.785 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.557 ' CD2' HD21 ' B' ' 432' ' ' LEU . 0.4 OUTLIER -57.55 -69.52 0.16 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -178.118 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.402 ' CD2' " H5'" ' A' ' 20' ' ' ' A' . 8.6 m-30 -83.93 -33.97 24.57 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -177.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.548 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.2 OUTLIER -81.97 -21.25 37.26 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.601 -0.44 . . . . 0.0 112.152 -178.932 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 2.3 mm? -123.83 -6.59 7.93 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.603 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.54 ' O ' ' N ' ' B' ' 380' ' ' TYR . 9.3 mm -145.6 -117.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 119.341 -0.361 . . . . 0.0 111.411 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.527 ' C ' ' O ' ' B' ' 378' ' ' ILE . . . -0.68 68.28 0.0 OUTLIER Glycine 0 C--N 1.346 1.096 0 N-CA-C 114.393 0.517 . . . . 0.0 114.393 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.547 ' CD1' ' HG2' ' B' ' 445' ' ' ARG . 0.1 OUTLIER -82.58 -78.07 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.02 0.438 . . . . 0.0 111.494 -179.764 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.421 ' CB ' ' O ' ' B' ' 380' ' ' TYR . . . 164.36 50.28 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.091 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -147.34 6.55 0.86 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.623 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.579 ' N ' ' CD1' ' B' ' 383' ' ' LEU . 0.0 OUTLIER -152.42 18.51 0.63 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.179 0.514 . . . . 0.0 110.77 179.834 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 32.77 73.56 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.671 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.495 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.2 OUTLIER -59.52 114.17 2.57 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 177.791 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -122.2 102.46 8.15 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -176.157 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.47 ' OH ' ' HB1' ' B' ' 431' ' ' ALA . 13.2 m-85 -76.43 165.37 24.92 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 175.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.539 HG21 ' O ' ' B' ' 403' ' ' GLU . 0.2 OUTLIER -148.52 167.95 3.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 C-N-CA 120.131 -0.628 . . . . 0.0 111.003 178.95 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 7.7 m -130.54 118.12 20.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.92 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.532 ' O ' HG22 ' B' ' 401' ' ' ILE . 20.3 m -130.03 153.4 38.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.799 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.43 ' HB2' ' CG2' ' B' ' 401' ' ' ILE . 0.1 OUTLIER 65.61 61.24 0.69 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.22 -179.779 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.19 139.19 56.08 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.472 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.535 ' CG ' " O3'" ' A' ' 5' ' ' ' U' . 11.0 Cg_endo -56.25 -172.89 0.04 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.574 2.183 . . . . 0.0 112.311 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.533 ' N ' ' HA ' ' B' ' 398' ' ' PRO . 54.9 p -157.02 -81.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.298 -0.41 . . . . 0.0 112.071 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . 167.76 -25.3 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 -179.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -116.22 -2.51 10.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.556 0.693 . . . . 0.0 110.16 178.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.438 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 1.3 m-20 179.06 56.39 0.06 OUTLIER Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.638 179.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.55 ' O ' ' O ' ' B' ' 399' ' ' ASN . 10.4 Cg_endo -54.57 -77.31 0.02 OUTLIER 'Trans proline' 0 CA--C 1.519 -0.251 0 C-N-CA 123.252 2.635 . . . . 0.0 112.884 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.55 ' O ' ' O ' ' B' ' 398' ' ' PRO . 0.4 OUTLIER 44.84 115.43 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.142 -179.542 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 400' ' ' SER . . . . . 0.475 ' O ' ' HB2' ' B' ' 423' ' ' ALA . 2.0 t -113.21 117.33 31.58 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.733 179.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.532 HG22 ' O ' ' B' ' 390' ' ' VAL . 0.5 OUTLIER -108.04 106.61 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 CA-C-O 121.305 0.574 . . . . 0.0 110.663 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.47 ' CG2' ' O ' ' B' ' 423' ' ' ALA . 0.3 OUTLIER -77.96 158.58 4.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.099 179.756 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.539 ' O ' HG21 ' B' ' 388' ' ' VAL . 7.2 tp10 -128.78 89.48 2.89 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.191 178.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.728 ' O ' ' O ' ' B' ' 411' ' ' VAL . 0.4 OUTLIER -82.42 114.83 21.13 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 178.076 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.528 ' HA ' ' O ' ' B' ' 411' ' ' VAL . 17.5 ptt85 -155.8 169.42 24.42 Favored 'General case' 0 C--O 1.226 -0.154 0 O-C-N 124.224 0.952 . . . . 0.0 109.744 -178.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.547 ' CG1' ' CD2' ' B' ' 412' ' ' LEU . 23.7 m -127.27 126.43 67.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.829 0.347 . . . . 0.0 111.772 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -35.05 -33.9 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 CA-C-N 115.709 -0.678 . . . . 0.0 113.314 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' B' ' 406' ' ' VAL . 15.1 t0 -59.47 -29.19 67.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.975 0.417 . . . . 0.0 110.675 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 118.03 47.26 0.44 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 121.038 -0.601 . . . . 0.0 111.769 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.509 ' HB ' ' CG2' ' B' ' 406' ' ' VAL . 0.2 OUTLIER -142.45 112.68 7.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.727 0.298 . . . . 0.0 111.402 -179.241 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.728 ' O ' ' O ' ' B' ' 404' ' ' CYS . 20.8 t -59.17 -63.7 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.55 ' HB2' ' O ' ' B' ' 411' ' ' VAL . 0.0 OUTLIER 86.09 -42.55 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 O-C-N 121.485 -0.759 . . . . 0.0 109.31 -178.336 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.518 ' O ' ' CB ' ' B' ' 404' ' ' CYS . . . 167.46 175.15 37.15 Favored Glycine 0 C--N 1.339 0.736 0 C-N-CA 119.61 -1.281 . . . . 0.0 113.742 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.49 ' OG1' ' N ' ' B' ' 415' ' ' GLY . 0.0 OUTLIER -142.63 -177.64 5.39 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.481 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.49 ' N ' ' OG1' ' B' ' 414' ' ' THR . . . -158.07 117.34 0.77 Allowed Glycine 0 C--O 1.223 -0.555 0 C-N-CA 118.742 -1.694 . . . . 0.0 114.273 -179.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' B' ' 400' ' ' SER . 38.3 t -107.45 145.07 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 178.34 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.482 ' HA3' HD11 ' B' ' 422' ' ' ILE . . . -166.91 145.94 10.36 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 119.531 -1.319 . . . . 0.0 113.467 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.449 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -66.44 -53.31 36.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 110.653 179.656 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.615 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.5 OUTLIER -79.73 -21.83 44.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.24 179.512 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.615 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 0.8 OUTLIER 99.07 -41.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 C-N-CA 124.038 0.935 . . . . 0.0 111.429 -179.215 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.592 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -50.32 -42.2 52.39 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.436 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.592 ' N ' ' CD ' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -56.72 -37.23 51.97 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.656 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 177.717 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.533 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -71.42 -31.55 67.37 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.145 179.061 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -71.39 -67.14 1.95 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.199 -1.001 . . . . 0.0 111.168 178.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.441 HD13 ' HG2' ' B' ' 421' ' ' LYS . 2.9 mp -51.66 -46.65 38.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 121.068 0.461 . . . . 0.0 110.207 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.566 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.4 tpt180 -54.25 -43.56 71.03 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.217 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.434 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -52.62 -49.99 63.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.175 179.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' B' ' 431' ' ' ALA . . . -54.75 -72.2 0.07 Allowed 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.22 0.533 . . . . 0.0 110.11 179.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.466 ' HA ' HD23 ' B' ' 432' ' ' LEU . 2.8 mt-10 -45.31 -28.02 0.76 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.936 179.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.521 ' ND2' ' HG3' ' B' ' 426' ' ' ARG . 0.6 OUTLIER -68.02 -34.12 75.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.333 179.4 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.513 ' N ' ' O ' ' B' ' 428' ' ' ALA . . . -65.24 -47.46 76.7 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.308 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.557 HD21 ' CD2' ' B' ' 374' ' ' LEU . 0.7 OUTLIER -88.28 20.23 3.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.565 179.667 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 8.4 ttt-85 -90.02 1.02 56.78 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.039 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.527 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 95.2 m-20 -114.69 76.09 0.97 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.67 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.449 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -39.33 -45.38 1.43 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 -179.716 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.449 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.2 mmpt? -63.36 -53.48 51.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.922 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.527 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 0.0 OUTLIER -60.14 -37.36 79.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.122 0.487 . . . . 0.0 109.97 179.501 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.493 ' CD2' ' HA ' ' B' ' 432' ' ' LEU . 58.6 mt -66.53 -55.62 14.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.213 179.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -64.62 -25.9 68.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.821 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.517 ' CE2' ' CE1' ' B' ' 441' ' ' TYR . 0.2 OUTLIER -69.4 -41.47 76.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.17 0.51 . . . . 0.0 109.663 179.34 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.544 ' CD1' ' OH ' ' B' ' 380' ' ' TYR . 16.0 m-85 -71.99 -39.87 68.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.707 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -54.79 -40.05 69.06 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . 0.442 ' O ' ' HE3' ' B' ' 443' ' ' LYS . 0.1 OUTLIER -69.94 -53.91 15.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.501 179.067 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.484 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -53.55 -30.38 41.55 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.182 0.515 . . . . 0.0 110.004 179.653 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.547 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -66.72 -53.74 30.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.681 179.697 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -61.52 -24.41 66.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.251 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.14 -53.55 5.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.191 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.538 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 15.4 pt -42.11 113.59 1.24 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.151 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -76.34 -166.69 0.39 Allowed 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 122.645 2.23 . . . . 0.0 111.994 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . 0.517 ' NH1' ' HB2' ' B' ' 450' ' ' ARG . 0.0 OUTLIER -142.57 104.32 4.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.939 0.399 . . . . 0.0 110.992 179.962 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -151.4 137.78 18.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.611 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.08 162.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.583 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 76.7 p . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.242 -0.885 . . . . 0.0 110.799 179.985 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.507 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.206 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.448 ' C ' ' O ' ' B' ' 367' ' ' ASP . 3.0 ttp -32.49 -52.21 0.29 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.507 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 32.0 m-20 -58.65 -49.79 76.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.224 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.61 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -54.86 -79.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.275 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.479 ' HD2' ' HB2' ' B' ' 367' ' ' ASP . 0.2 OUTLIER -29.33 -45.15 0.04 OUTLIER 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.031 0.443 . . . . 0.0 111.016 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.525 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -61.64 -61.64 2.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.323 179.551 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.668 ' HB3' HD22 ' B' ' 432' ' ' LEU . 0.8 OUTLIER -40.93 -34.55 0.42 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.221 0.534 . . . . 0.0 110.137 179.309 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.648 HD23 ' N ' ' B' ' 374' ' ' LEU . 2.6 mt -68.29 -80.9 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.211 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.88 27.79 0.85 Allowed 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -178.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.525 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 1.1 p -135.92 -31.57 0.92 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.241 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.762 ' O ' HD13 ' B' ' 378' ' ' ILE . 1.1 mm? -109.39 -27.85 9.26 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.762 HD13 ' O ' ' B' ' 377' ' ' LEU . 19.0 mm -129.5 -62.5 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.804 -179.2 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.847 ' HA2' HD12 ' B' ' 383' ' ' LEU . . . -32.64 102.72 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.732 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.529 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 10.1 p90 -115.04 177.73 4.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.888 0.375 . . . . 0.0 110.831 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' B' ' 382' ' ' SER . . . -65.99 118.14 9.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.213 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.464 ' HB3' ' O ' ' B' ' 381' ' ' ALA . 8.4 t 79.13 45.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.224 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.847 HD12 ' HA2' ' B' ' 379' ' ' GLY . 0.1 OUTLIER -95.39 -42.16 8.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.809 0.338 . . . . 0.0 110.706 179.675 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.513 ' CB ' ' O ' ' B' ' 383' ' ' LEU . 3.8 tpm_? 84.56 -6.16 0.99 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.106 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.921 ' HA ' HG12 ' B' ' 406' ' ' VAL . 4.5 tt -36.02 129.5 0.66 Allowed 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.778 0.323 . . . . 0.0 110.583 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.445 ' N ' HD23 ' B' ' 385' ' ' LEU . 3.7 p80 -161.22 147.37 14.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.647 0.737 . . . . 0.0 112.862 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.494 ' OH ' ' HA ' ' B' ' 428' ' ' ALA . 11.9 m-85 -105.12 141.95 35.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.97 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -121.72 123.29 69.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.091 0.472 . . . . 0.0 111.289 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.15 130.41 38.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.629 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.669 HG23 ' CG2' ' B' ' 401' ' ' ILE . 28.0 m -141.36 144.9 25.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.964 0.411 . . . . 0.0 110.915 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.566 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 7.9 tptt 95.68 56.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.531 -179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.451 ' HA ' ' HD2' ' B' ' 393' ' ' PRO . 4.2 mmpt? -31.21 107.41 0.25 Allowed Pre-proline 0 N--CA 1.462 0.154 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.206 -179.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.489 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 4.3 Cg_exo -44.98 159.53 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.799 2.333 . . . . 0.0 113.353 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 16.6 p -128.12 158.27 38.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.972 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -86.28 13.83 7.45 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.597 179.281 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 3.0 m -136.96 14.05 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.082 177.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.4 ' H ' ' HD3' ' B' ' 398' ' ' PRO . 0.4 OUTLIER 166.45 61.56 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 114.496 -1.229 . . . . 0.0 108.797 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.489 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 96.4 Cg_exo -42.8 -32.18 2.45 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.225 2.617 . . . . 0.0 113.086 -179.034 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.608 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.8 OUTLIER -30.67 127.21 0.15 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.022 -178.761 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 47.7 t -136.55 166.92 22.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.848 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.669 ' CG2' HG23 ' B' ' 390' ' ' VAL . 15.3 tt -122.51 161.98 22.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.105 0.478 . . . . 0.0 111.495 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.754 ' O ' HG22 ' B' ' 414' ' ' THR . 0.1 OUTLIER -128.68 143.76 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.943 -179.624 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 403' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -110.69 125.78 53.84 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.742 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 41.3 t -106.18 107.21 18.1 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.698 ' HB3' HG22 ' B' ' 411' ' ' VAL . 0.0 OUTLIER -147.65 -171.31 3.78 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.196 0.522 . . . . 0.0 111.536 -179.131 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.921 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.1 OUTLIER -135.85 147.5 28.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.157 -179.395 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 407' ' ' GLY . . . . . 0.456 ' HA3' ' HG2' ' B' ' 384' ' ' ARG . . . -35.34 -28.8 0.01 OUTLIER Glycine 0 C--N 1.332 0.311 0 CA-C-N 115.488 -0.778 . . . . 0.0 113.62 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 408' ' ' ASP . . . . . 0.463 ' N ' ' O ' ' B' ' 406' ' ' VAL . 59.3 m-20 -70.31 -3.17 15.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.877 0.37 . . . . 0.0 111.099 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 409' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 82.26 33.06 26.9 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.783 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.535 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 19.3 m -116.18 118.38 32.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.587 0.232 . . . . 0.0 111.375 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.698 HG22 ' HB3' ' B' ' 405' ' ' ARG . 70.9 t -92.32 111.9 25.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.156 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.535 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.5 OUTLIER -67.37 -36.21 80.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.364 -0.38 . . . . 0.0 109.978 179.164 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.45 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . -175.29 -152.57 9.45 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.518 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.754 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.1 OUTLIER -159.92 174.17 14.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.475 0.179 . . . . 0.0 110.701 -179.84 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.678 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -169.03 128.51 1.7 Allowed Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.133 -1.032 . . . . 0.0 112.877 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 7.1 p -123.49 155.59 29.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.853 0.358 . . . . 0.0 110.411 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.983 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -164.43 169.22 39.13 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.554 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 418' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -79.98 -39.95 29.0 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 117.312 0.556 . . . . 0.0 111.532 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.854 ' OD1' HD11 ' B' ' 422' ' ' ILE . 3.0 p-10 -101.99 31.75 3.77 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.763 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.79 -46.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.635 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -44.42 -55.17 5.23 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 118.796 0.725 . . . . 0.0 109.806 -179.474 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.983 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -42.83 -34.26 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.571 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.194 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.763 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -68.61 -44.81 73.48 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.184 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -60.03 -62.98 5.47 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.181 -1.009 . . . . 0.0 111.676 179.158 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.684 ' H ' HD12 ' B' ' 425' ' ' ILE . 4.4 mp -56.73 -42.24 76.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.91 0.386 . . . . 0.0 110.393 179.315 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.579 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -56.02 -43.57 77.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.126 179.434 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.591 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -56.41 -50.51 71.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.337 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.61 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -55.08 -59.65 4.46 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.665 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.468 ' O ' ' HB3' ' B' ' 433' ' ' ARG . 2.9 mt-10 -50.07 -29.87 9.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.124 0.488 . . . . 0.0 109.838 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.514 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 0.8 OUTLIER -67.79 -38.12 82.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.398 179.5 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.742 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -62.69 -41.79 99.29 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.165 0.507 . . . . 0.0 110.204 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.668 HD22 ' HB3' ' B' ' 373' ' ' GLN . 0.1 OUTLIER -87.26 5.94 35.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.362 179.124 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.514 ' CG ' ' O ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -89.4 11.81 18.14 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.109 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.569 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 14.4 m-20 -125.81 81.38 1.98 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.521 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 12.3 ptpt -46.93 -49.35 20.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.427 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.521 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.2 mmmm -61.22 -46.12 91.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.742 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.569 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 18.9 tmm? -63.24 -45.92 89.31 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.003 0.43 . . . . 0.0 110.076 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.459 HD11 ' HA ' ' B' ' 432' ' ' LEU . 84.3 mt -57.37 -62.42 1.78 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.915 179.231 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -54.03 -32.28 53.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.014 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.475 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.7 OUTLIER -57.86 -43.3 85.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.118 179.661 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 441' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -73.81 -28.31 61.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.568 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.57 -51.37 67.34 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 11.0 ttpp -63.31 -48.14 79.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.577 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 444' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -50.11 -44.93 52.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.81 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.529 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.361 179.506 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.855 0.359 . . . . 0.0 110.495 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.491 ' O ' ' HB2' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -40.76 -42.67 1.82 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.587 179.662 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -63.84 -36.92 85.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.521 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.645 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -68.54 -74.26 0.13 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.605 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.434 ' C ' ' O ' ' B' ' 370' ' ' ALA . 0.1 OUTLIER -37.11 -44.08 0.53 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.076 0.465 . . . . 0.0 110.274 179.67 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.554 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.6 OUTLIER -64.31 -42.65 96.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.764 179.695 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.515 ' HA ' ' HB2' ' B' ' 377' ' ' LEU . 0.4 OUTLIER -57.34 -42.83 82.72 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.174 0.512 . . . . 0.0 110.563 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.569 ' CD2' HD12 ' B' ' 432' ' ' LEU . 0.4 OUTLIER -64.69 -72.79 0.14 Allowed 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -178.62 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 4.6 m-30 -79.54 -25.02 41.78 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -177.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -91.08 -31.71 16.15 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.872 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.941 ' O ' HD13 ' B' ' 378' ' ' ILE . 4.6 mm? -110.85 -13.63 14.11 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.711 -0.396 . . . . 0.0 112.056 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.941 HD13 ' O ' ' B' ' 377' ' ' LEU . 12.5 mm -141.99 -121.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.678 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.516 ' C ' ' O ' ' B' ' 378' ' ' ILE . . . -13.9 82.2 0.0 OUTLIER Glycine 0 C--N 1.343 0.971 0 N-CA-C 114.13 0.412 . . . . 0.0 114.13 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.669 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 0.6 OUTLIER -74.27 -58.97 2.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.764 0.316 . . . . 0.0 110.317 179.591 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.669 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 155.28 34.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.481 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.98 16.95 0.67 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.657 0.265 . . . . 0.0 111.188 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.929 HD13 ' HB2' ' B' ' 385' ' ' LEU . 0.2 OUTLIER -123.87 26.16 7.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.975 0.417 . . . . 0.0 110.635 179.565 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.474 ' HG3' ' HA3' ' B' ' 407' ' ' GLY . 0.0 OUTLIER 36.79 41.28 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.15 179.858 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.929 ' HB2' HD13 ' B' ' 383' ' ' LEU . 1.1 tt -69.2 132.62 46.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.978 0.418 . . . . 0.0 110.752 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 -169.05 135.25 1.7 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.298 0.57 . . . . 0.0 112.194 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.609 ' OH ' ' HB2' ' B' ' 431' ' ' ALA . 2.3 m-85 -84.41 178.55 7.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.325 -0.852 . . . . 0.0 108.741 178.122 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.656 HG23 ' O ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -153.6 108.57 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.297 0.57 . . . . 0.0 112.153 178.525 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.2 m -72.18 100.04 2.48 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.269 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.809 HG23 HG23 ' B' ' 401' ' ' ILE . 32.6 m -107.96 148.66 11.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.234 0.54 . . . . 0.0 111.116 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.464 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 15.1 tptt 80.82 55.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.406 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.443 ' C ' ' O ' ' B' ' 391' ' ' LYS . 3.0 mmpt? -33.88 131.33 0.4 Allowed Pre-proline 0 C--N 1.332 -0.152 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.555 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.537 ' HA ' ' O ' ' B' ' 398' ' ' PRO . 52.2 Cg_exo -53.74 174.42 0.15 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.554 2.169 . . . . 0.0 112.912 -178.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.527 ' OG1' ' N ' ' B' ' 397' ' ' ASP . 3.8 p -140.99 151.4 44.11 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.512 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -76.76 -5.37 47.86 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.137 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 396' ' ' VAL . . . . . 0.416 ' O ' ' OD1' ' B' ' 397' ' ' ASP . 35.7 m -125.39 9.46 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.485 0.659 . . . . 0.0 110.073 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.527 ' N ' ' OG1' ' B' ' 394' ' ' THR . 7.5 m-20 179.18 63.19 0.11 Allowed Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 114.918 -1.037 . . . . 0.0 109.687 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.537 ' O ' ' HA ' ' B' ' 393' ' ' PRO . 39.7 Cg_exo -31.27 -65.99 0.08 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.333 2.689 . . . . 0.0 112.618 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.513 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 14.3 m120 7.71 116.6 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 400' ' ' SER . . . . . 0.485 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 0.3 OUTLIER -134.14 149.74 51.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.577 178.503 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.809 HG23 HG23 ' B' ' 390' ' ' VAL . 1.3 tp -127.36 130.09 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 121.324 0.583 . . . . 0.0 112.478 -178.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.73 ' O ' HG22 ' B' ' 414' ' ' THR . 0.7 OUTLIER -91.47 161.44 2.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.182 179.501 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.656 ' O ' HG23 ' B' ' 388' ' ' VAL . 0.8 OUTLIER -138.58 96.83 3.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.97 0.414 . . . . 0.0 111.239 179.348 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -77.83 112.68 14.95 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.69 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.684 ' HD3' HG22 ' B' ' 411' ' ' VAL . 35.9 ttp180 -147.05 161.84 40.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.138 0.494 . . . . 0.0 111.551 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.681 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -130.56 128.8 63.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.149 -179.184 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 407' ' ' GLY . . . . . 0.474 ' HA3' ' HG3' ' B' ' 384' ' ' ARG . . . -30.03 -34.48 0.01 OUTLIER Glycine 0 C--N 1.334 0.442 0 C-N-CA 121.284 -0.484 . . . . 0.0 113.686 -179.314 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 408' ' ' ASP . . . . . 0.514 ' N ' ' O ' ' B' ' 406' ' ' VAL . 6.5 m-20 -55.19 -18.51 6.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.059 0.457 . . . . 0.0 110.386 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 99.35 32.35 5.81 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.834 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.571 ' HB ' HG23 ' B' ' 406' ' ' VAL . 40.0 m -122.19 121.38 36.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.964 0.412 . . . . 0.0 111.53 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.684 HG22 ' HD3' ' B' ' 405' ' ' ARG . 38.6 t -90.29 84.67 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.439 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.796 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -43.06 -23.32 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.34 -179.598 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.445 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 161.61 -174.01 38.07 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.013 -1.089 . . . . 0.0 113.044 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.73 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -143.08 171.73 13.67 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.714 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -160.7 144.06 9.58 Favored Glycine 0 C--O 1.221 -0.692 0 C-N-CA 119.779 -1.2 . . . . 0.0 113.16 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 5.0 p -132.86 155.01 40.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.513 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -170.3 151.65 17.03 Favored Glycine 0 N--CA 1.453 -0.187 0 C-N-CA 120.02 -1.086 . . . . 0.0 113.293 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.514 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 2.3 mtm-85 -70.51 -55.26 9.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.907 0.384 . . . . 0.0 110.499 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.879 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.1 OUTLIER -75.63 -21.65 57.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.888 179.217 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.879 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 98.14 -41.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.113 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.144 -179.291 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.596 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -52.95 -40.41 63.64 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.579 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.688 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -59.14 -35.92 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.748 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 177.355 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.644 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -68.73 -36.65 78.68 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.016 178.14 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.76 -67.14 2.15 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.952 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.41 ' O ' ' HB3' ' B' ' 428' ' ' ALA . 2.4 mp -53.81 -48.3 61.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.598 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -50.08 -49.57 51.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.178 179.402 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.539 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -49.68 -44.63 48.01 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.144 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.677 ' O ' HD13 ' B' ' 432' ' ' LEU . . . -57.35 -68.07 0.27 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.552 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.407 ' HA ' HD11 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -43.6 -25.6 0.18 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.668 179.791 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.445 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 11.3 m-80 -79.6 -32.88 41.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.712 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.609 ' HB2' ' OH ' ' B' ' 387' ' ' TYR . . . -65.52 -40.99 93.6 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 120.87 0.367 . . . . 0.0 110.517 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.902 ' O ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -95.85 25.86 4.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.479 0.657 . . . . 0.0 109.905 179.032 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 6.1 ttt180 -96.38 -8.83 31.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.087 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -101.16 96.68 7.37 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.788 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.523 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 4.4 ptpp? -51.78 -51.11 58.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.259 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.523 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 8.6 mmtt -56.25 -50.12 72.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.98 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.796 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -66.61 -43.49 84.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.93 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.902 HD11 ' O ' ' B' ' 432' ' ' LEU . 35.8 mt -61.72 -55.73 27.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.22 0.534 . . . . 0.0 111.103 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 439' ' ' ASP . . . . . 0.507 ' O ' ' HG3' ' B' ' 443' ' ' LYS . 20.2 t70 -65.39 -27.35 68.49 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.169 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -59.79 -47.43 85.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.949 -0.568 . . . . 0.0 109.994 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.626 ' HB2' HG23 ' B' ' 378' ' ' ILE . 60.8 m-85 -75.02 -35.43 61.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.592 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -48.57 -51.85 25.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.947 0.403 . . . . 0.0 110.075 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 443' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' B' ' 439' ' ' ASP . 0.0 OUTLIER -72.65 -46.93 51.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.873 179.035 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.482 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.7 OUTLIER -53.69 -19.18 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.697 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.564 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.808 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.9 OUTLIER . . . . . 0 C--O 1.233 0.201 0 CA-C-O 120.888 0.375 . . . . 0.0 110.12 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.511 ' HA ' ' HD2' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -34.59 -45.56 0.25 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.429 179.772 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -59.39 -48.01 83.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.509 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 1.025 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -62.33 -75.28 0.08 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.581 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -31.58 -41.92 0.05 OUTLIER 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.105 -179.673 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.58 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.4 OUTLIER -65.44 -45.59 83.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.346 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.608 ' OE1' HD13 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -58.91 -39.58 81.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.177 0.513 . . . . 0.0 111.153 -179.792 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.48 HD11 ' OH ' ' B' ' 387' ' ' TYR . 1.3 mm? -67.66 -71.09 0.22 Allowed 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 375' ' ' TYR . . . . . 0.505 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-30 -87.37 5.88 36.45 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -177.325 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.58 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -122.56 -20.35 6.04 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.103 179.321 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.772 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.8 OUTLIER -116.15 -27.42 6.9 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.453 179.75 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.772 HD13 ' O ' ' B' ' 377' ' ' LEU . 3.7 mm -142.07 33.58 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.112 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.505 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -122.28 86.27 0.39 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.72 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.535 ' CD2' ' HD3' ' B' ' 445' ' ' ARG . 5.1 p90 -97.86 167.63 10.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.726 0.298 . . . . 0.0 110.491 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.55 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -66.9 114.86 6.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.916 0.389 . . . . 0.0 111.714 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.55 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.4 p 90.42 44.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.881 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.507 ' CD1' ' O ' ' B' ' 378' ' ' ILE . 1.0 OUTLIER -92.61 -40.41 10.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.939 0.4 . . . . 0.0 110.684 179.657 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.446 ' CB ' ' O ' ' B' ' 383' ' ' LEU . 2.0 tpt180 81.78 -8.95 1.28 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.106 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.815 ' HA ' HG12 ' B' ' 406' ' ' VAL . 7.9 tt -40.83 136.02 1.53 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.493 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.523 ' N ' HD23 ' B' ' 385' ' ' LEU . 9.1 p-80 -164.11 148.85 10.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.541 0.686 . . . . 0.0 112.577 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.514 ' CD2' ' HB1' ' B' ' 427' ' ' ALA . 2.8 m-85 -101.23 141.95 33.37 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.989 179.112 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.666 HG23 ' HB2' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -121.25 120.02 60.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.16 0.505 . . . . 0.0 111.324 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 10.6 m -76.27 134.38 39.8 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.77 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.983 HG23 HG23 ' B' ' 401' ' ' ILE . 20.8 m -141.14 157.78 22.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.874 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.636 ' HB2' HG22 ' B' ' 401' ' ' ILE . 4.5 tmtt? 85.99 62.6 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.21 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.461 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER -29.47 125.92 0.26 Allowed Pre-proline 0 C--N 1.334 -0.075 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.001 -179.492 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.478 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 8.1 Cg_exo -70.39 161.16 47.02 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.559 2.173 . . . . 0.0 113.023 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.439 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 1.6 p -135.78 165.49 25.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.92 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -90.97 19.86 5.32 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.361 0.6 . . . . 0.0 110.478 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 14.5 m -139.78 14.19 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.329 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.478 ' H ' ' CD ' ' B' ' 398' ' ' PRO . 4.6 m-20 163.82 54.63 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.839 -179.48 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.478 ' CD ' ' H ' ' B' ' 397' ' ' ASP . 5.2 Cg_exo -40.15 -25.56 0.17 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.509 2.806 . . . . 0.0 112.818 -179.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 52.5 p30 -30.99 148.41 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.328 0.585 . . . . 0.0 112.082 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -155.26 155.85 34.53 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.281 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.983 HG23 HG23 ' B' ' 390' ' ' VAL . 0.2 OUTLIER -108.49 152.8 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.448 179.707 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.702 HG23 ' HB1' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -123.48 142.69 39.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.736 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.666 ' HB2' HG23 ' B' ' 388' ' ' VAL . 1.8 mt-10 -108.29 128.4 54.71 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 179.161 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.545 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.8 OUTLIER -108.09 109.57 21.04 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.099 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.73 ' HB3' HG22 ' B' ' 411' ' ' VAL . 0.0 OUTLIER -145.59 -156.68 0.73 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.181 0.515 . . . . 0.0 111.704 -178.894 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.815 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -151.86 143.34 15.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.271 -179.443 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -38.23 -27.56 0.04 OUTLIER Glycine 0 C--N 1.332 0.353 0 CA-C-N 115.612 -0.722 . . . . 0.0 113.361 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 408' ' ' ASP . . . . . 0.575 ' OD1' HG23 ' B' ' 406' ' ' VAL . 47.0 p30 -69.51 -4.71 20.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.812 0.339 . . . . 0.0 110.878 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 409' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 85.04 39.33 8.61 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.156 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.564 ' HB ' HG23 ' B' ' 406' ' ' VAL . 12.8 m -127.31 118.29 23.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.724 0.297 . . . . 0.0 111.659 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.73 HG22 ' HB3' ' B' ' 405' ' ' ARG . 52.1 t -92.96 112.1 25.67 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.807 179.364 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.613 ' HG ' ' HE1' ' B' ' 437' ' ' MET . 0.5 OUTLIER -67.24 -37.64 83.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.383 179.418 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.49 ' O ' ' HB ' ' B' ' 414' ' ' THR . . . -174.35 -150.66 7.82 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.505 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.49 ' HB ' ' O ' ' B' ' 413' ' ' GLY . 13.2 t 176.09 155.3 0.21 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.694 0.283 . . . . 0.0 111.028 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.502 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -150.52 -177.18 24.2 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.461 -0.876 . . . . 0.0 112.796 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 2.2 p -153.16 161.55 2.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.796 0.331 . . . . 0.0 110.926 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.981 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -166.21 171.63 41.31 Favored Glycine 0 C--O 1.225 -0.454 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.933 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.443 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.0 OUTLIER -83.64 -39.92 19.64 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 117.067 0.434 . . . . 0.0 111.362 -179.857 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.85 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -104.44 31.81 4.43 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.048 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.56 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.33 -45.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 178.875 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.631 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -45.9 -49.35 15.67 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.296 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.981 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.49 -40.62 7.08 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.62 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.935 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.702 ' HB1' HG23 ' B' ' 402' ' ' VAL . . . -65.77 -40.42 91.99 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.485 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.92 -67.91 1.89 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.552 -0.832 . . . . 0.0 111.227 178.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.515 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 1.1 mp -52.52 -47.27 48.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.602 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 11.4 tpt180 -51.37 -47.95 62.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.72 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.622 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -47.36 -49.52 24.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.46 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 1.025 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -56.34 -57.66 11.31 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.656 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.657 ' HA ' HD21 ' B' ' 432' ' ' LEU . 0.5 OUTLIER -49.36 -20.05 0.61 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.712 179.257 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.504 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 4.3 m-80 -83.86 -36.91 23.08 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.916 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.4 ' HB3' HD21 ' B' ' 374' ' ' LEU . . . -65.42 -40.69 93.65 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.857 0.36 . . . . 0.0 111.167 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.8 HD13 ' O ' ' B' ' 428' ' ' ALA . 0.0 OUTLIER -89.57 9.41 26.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.98 179.89 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.528 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 23.8 ttm180 -89.97 3.74 52.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.077 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.456 ' HB3' ' CB ' ' B' ' 437' ' ' MET . 48.3 m-20 -115.09 87.34 2.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.896 0.379 . . . . 0.0 111.116 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.531 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -50.19 -51.23 45.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.987 179.506 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.531 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -57.94 -43.84 86.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.602 179.61 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.613 ' HE1' ' HG ' ' B' ' 412' ' ' LEU . 9.2 tmm? -66.48 -49.67 65.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.134 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.608 HD13 ' OE1' ' B' ' 373' ' ' GLN . 47.4 mt -54.91 -63.31 1.19 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.042 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -56.22 -31.1 63.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.938 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.3 OUTLIER -59.22 -38.95 81.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.105 179.723 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.436 ' O ' ' HB2' ' B' ' 445' ' ' ARG . 43.3 m-85 -82.62 -21.09 35.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.782 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -67.47 -52.48 38.77 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -61.69 -45.0 95.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.502 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 444' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -59.63 -52.96 63.28 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.941 179.003 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.535 ' HD3' ' CD2' ' B' ' 380' ' ' TYR . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.269 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.718 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.589 ' OD1' HD12 ' B' ' 425' ' ' ILE . 7.3 t0 . . . . . 0 CA--C 1.521 -0.153 0 CA-C-O 120.713 0.292 . . . . 0.0 110.464 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.443 ' C ' ' O ' ' B' ' 367' ' ' ASP . 0.9 OUTLIER -33.49 -52.57 0.39 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.72 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 369' ' ' ASN . . . . . 0.42 ' OD1' ' CE ' ' B' ' 368' ' ' MET . 66.2 m-20 -60.0 -42.73 94.88 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.401 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.836 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -61.35 -78.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.796 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -32.03 -44.75 0.09 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.834 -179.606 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.506 ' O ' ' HB2' ' B' ' 376' ' ' SER . 0.0 OUTLIER -58.62 -58.93 6.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.355 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 1.072 ' NE2' HD23 ' B' ' 377' ' ' LEU . 2.4 tm0? -47.28 -56.13 7.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.331 0.586 . . . . 0.0 110.974 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.732 HD23 ' N ' ' B' ' 374' ' ' LEU . 2.0 mt -46.39 -69.76 0.12 Allowed 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -178.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -89.77 -45.16 9.48 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -176.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.506 ' HB2' ' O ' ' B' ' 372' ' ' ARG . 49.6 m -67.48 -20.78 65.51 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.753 -179.071 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 1.072 HD23 ' NE2' ' B' ' 373' ' ' GLN . 2.1 tp -110.82 -39.25 4.89 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 120.639 0.257 . . . . 0.0 110.836 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.615 HG22 ' H ' ' B' ' 379' ' ' GLY . 1.9 mm -126.91 -151.42 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.615 ' H ' HG22 ' B' ' 378' ' ' ILE . . . 40.81 64.85 1.14 Allowed Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.532 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.706 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 4.2 p90 -81.36 -61.74 1.86 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.558 0.179 . . . . 0.0 111.307 -179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.706 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 160.15 71.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 8.7 t 156.21 21.89 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.559 HD23 ' H ' ' B' ' 383' ' ' LEU . 0.8 OUTLIER -117.4 -26.39 6.7 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 122.063 -0.398 . . . . 0.0 110.949 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.497 ' HB3' ' O ' ' B' ' 383' ' ' LEU . 8.7 tpp180 79.59 48.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.552 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.74 HD23 ' N ' ' B' ' 386' ' ' HIS . 5.2 tt -84.25 132.57 34.63 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.031 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.74 ' N ' HD23 ' B' ' 385' ' ' LEU . 13.1 p-80 -164.94 147.8 8.36 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -179.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.463 ' CZ ' ' SG ' ' B' ' 404' ' ' CYS . 7.4 m-85 -103.26 144.92 30.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.133 178.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.611 HG23 ' HB2' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -123.97 125.17 70.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.167 0.508 . . . . 0.0 110.799 179.229 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.4 m -83.92 126.18 32.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.964 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.698 HG23 ' CG2' ' B' ' 401' ' ' ILE . 27.2 m -134.39 155.32 38.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.812 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.518 ' HB3' ' O ' ' B' ' 390' ' ' VAL . 11.6 tptp 86.82 57.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.599 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER -33.87 122.02 0.49 Allowed Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.515 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.438 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 17.1 Cg_exo -63.14 162.33 26.76 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.608 2.205 . . . . 0.0 112.701 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.9 p -134.49 170.14 16.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.888 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -93.47 16.93 12.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.833 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 29.5 m -135.9 11.8 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.441 178.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.433 ' O ' ' N ' ' B' ' 399' ' ' ASN . 1.1 m-20 163.78 64.84 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.218 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.477 ' O ' ' C ' ' B' ' 399' ' ' ASN . 4.7 Cg_exo -37.05 -28.88 0.08 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 123.557 2.838 . . . . 0.0 112.363 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.497 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 8.3 m120 -21.91 121.88 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.483 -0.781 . . . . 0.0 112.347 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 5.9 t -143.22 154.5 43.91 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.795 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.698 ' CG2' HG23 ' B' ' 390' ' ' VAL . 16.8 tt -120.26 159.08 21.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.343 0.592 . . . . 0.0 111.381 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.847 ' O ' HG22 ' B' ' 414' ' ' THR . 0.2 OUTLIER -121.08 152.61 24.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.276 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.611 ' HB2' HG23 ' B' ' 388' ' ' VAL . 32.3 mt-10 -122.12 125.31 45.9 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.981 0.42 . . . . 0.0 110.107 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.624 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 48.3 t -110.4 111.84 23.38 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.582 ' HB3' HG22 ' B' ' 411' ' ' VAL . 15.3 ptp180 -145.85 -175.86 4.91 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.232 0.539 . . . . 0.0 111.651 -179.183 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.618 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -146.68 144.96 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.134 -179.388 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 407' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' B' ' 408' ' ' ASP . . . 66.54 6.24 34.03 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.265 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 408' ' ' ASP . . . . . 0.498 ' HB3' ' O ' ' B' ' 407' ' ' GLY . 59.8 t0 74.85 39.66 0.4 Allowed 'General case' 0 C--O 1.23 0.078 0 CA-C-O 120.639 0.257 . . . . 0.0 111.536 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -167.12 -50.66 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.303 -0.951 . . . . 0.0 113.054 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.618 ' HB ' HG23 ' B' ' 406' ' ' VAL . 17.6 m -72.97 94.98 1.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.598 0.237 . . . . 0.0 111.2 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.582 HG22 ' HB3' ' B' ' 405' ' ' ARG . 95.4 t -82.82 111.46 19.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.786 0.327 . . . . 0.0 111.294 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.558 HD22 ' HA ' ' B' ' 405' ' ' ARG . 0.7 OUTLIER -65.44 -32.84 74.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.368 179.149 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.404 ' HA3' ' OD1' ' B' ' 430' ' ' ASN . . . 178.55 -158.25 22.63 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.608 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.847 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -156.19 167.67 29.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.791 0.329 . . . . 0.0 111.146 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.667 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -159.42 124.59 1.37 Allowed Glycine 0 C--O 1.225 -0.464 0 C-N-CA 120.531 -0.843 . . . . 0.0 112.572 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.438 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 10.1 p -124.33 151.88 29.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.778 0.323 . . . . 0.0 110.842 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.946 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -167.03 159.49 32.89 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.212 -0.994 . . . . 0.0 113.284 -179.624 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.4 OUTLIER -67.18 -45.68 76.21 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.402 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.822 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -98.68 30.17 3.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.215 0.531 . . . . 0.0 109.586 179.078 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.63 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 50.41 -44.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 115.227 1.566 . . . . 0.0 115.227 178.319 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.621 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -47.43 -48.93 26.24 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.595 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.946 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.06 -37.23 3.84 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.628 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.169 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -69.02 -46.51 67.77 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.698 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.97 -59.34 10.95 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.429 -0.891 . . . . 0.0 111.424 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.784 ' N ' HD13 ' B' ' 425' ' ' ILE . 1.2 mm -60.93 -40.15 84.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.804 0.335 . . . . 0.0 110.806 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.585 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 25.2 tpt180 -57.41 -42.09 81.6 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.376 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.643 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -62.12 -45.26 94.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.394 179.469 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.836 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -56.16 -59.47 4.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.37 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.49 ' O ' ' HB2' ' B' ' 433' ' ' ARG . 1.0 OUTLIER -50.73 -31.46 16.71 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.127 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.501 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -63.86 -39.74 94.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.646 179.532 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.624 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -65.0 -41.62 95.21 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 120.993 0.425 . . . . 0.0 110.324 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.673 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.3 OUTLIER -86.24 9.12 18.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.592 179.353 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 2.3 ttm-85 -93.99 11.4 29.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.767 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.553 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 2.3 m-20 -125.39 79.81 1.84 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.805 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.505 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 10.4 ptpt -46.27 -48.9 17.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.016 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.505 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 3.3 mtpp -57.62 -46.62 83.9 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.817 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.553 ' HB3' ' HB2' ' B' ' 434' ' ' ASP . 1.5 tmm? -64.27 -65.12 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.049 0.452 . . . . 0.0 109.895 179.184 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.673 HD11 ' HA ' ' B' ' 432' ' ' LEU . 44.6 mt -39.13 -67.59 0.21 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.05 179.285 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -47.8 -43.95 28.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.69 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.464 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -52.64 -32.57 42.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.969 179.868 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.447 ' HB2' ' O ' ' B' ' 438' ' ' LEU . 25.7 m-85 -75.57 -41.33 55.0 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.756 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.426 ' O ' ' HB2' ' B' ' 445' ' ' ARG . . . -49.25 -43.9 43.26 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.333 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 443' ' ' LYS . . . . . 0.403 ' HD3' ' N ' ' B' ' 444' ' ' GLN . 0.1 OUTLIER -62.85 -50.45 70.86 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.769 178.512 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.403 ' N ' ' HD3' ' B' ' 443' ' ' LYS . 1.3 mt-30 -55.52 -36.57 66.87 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.775 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.617 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 5.0 mmm-85 . . . . . 0 CA--C 1.519 -0.214 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.489 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.694 ' HA ' HG23 ' B' ' 425' ' ' ILE . 0.4 OUTLIER . . . . . 0 C--O 1.237 0.447 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.473 ' HE2' ' H ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -32.91 -56.09 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.112 178.93 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 369' ' ' ASN . . . . . 0.473 ' H ' ' HE2' ' B' ' 368' ' ' MET . 0.5 OUTLIER -52.31 -56.1 17.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.376 179.717 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.991 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -43.4 -75.99 0.03 OUTLIER 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.448 ' HD3' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -35.78 -38.07 0.11 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.22 0.533 . . . . 0.0 110.36 179.849 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.545 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.1 tmt_? -59.6 -55.86 29.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.324 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.695 ' HB3' HD22 ' B' ' 432' ' ' LEU . 0.2 OUTLIER -50.4 -32.23 17.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.736 179.614 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.759 HD11 ' OH ' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -71.34 -78.41 0.08 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.714 -178.979 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -79.44 12.76 2.28 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -178.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -128.09 -28.46 2.62 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.705 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.993 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.4 OUTLIER -110.03 -16.9 13.71 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.758 -179.646 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.993 HD13 ' O ' ' B' ' 377' ' ' LEU . 13.9 mm -132.35 -60.02 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 121.005 0.431 . . . . 0.0 110.041 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.618 ' HA2' HD12 ' B' ' 383' ' ' LEU . . . -53.04 143.56 25.31 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.146 179.322 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.641 ' CE1' ' CZ ' ' B' ' 445' ' ' ARG . 0.5 OUTLIER -143.95 -48.94 0.29 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.557 -0.322 . . . . 0.0 111.537 179.82 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.526 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 171.76 -26.06 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.46 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.565 ' HB2' ' CE2' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -111.22 -6.51 14.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.808 0.337 . . . . 0.0 110.913 179.817 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.827 HD13 ' HB2' ' B' ' 385' ' ' LEU . 0.1 OUTLIER -48.18 -51.58 24.5 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.923 -179.968 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.484 ' HG2' ' HA3' ' B' ' 407' ' ' GLY . 2.3 tpt180 77.56 6.4 2.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.607 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.827 ' HB2' HD13 ' B' ' 383' ' ' LEU . 3.7 tt -49.54 135.28 18.51 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.793 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.417 ' CD2' ' O ' ' B' ' 386' ' ' HIS . 8.7 p-80 -153.35 134.46 14.06 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.365 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.759 ' OH ' HD11 ' B' ' 374' ' ' LEU . 6.9 m-85 -92.41 140.97 29.04 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.8 179.291 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -125.62 124.61 67.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.977 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 6.9 m -82.19 130.79 35.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.322 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 1.007 HG23 HG23 ' B' ' 401' ' ' ILE . 21.6 m -135.25 160.07 40.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.279 0.562 . . . . 0.0 110.983 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.653 ' CB ' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 73.85 53.7 0.11 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.533 -179.623 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.476 ' C ' ' O ' ' B' ' 391' ' ' LYS . 3.7 mmtp -25.52 136.29 0.08 OUTLIER Pre-proline 0 N--CA 1.464 0.269 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.425 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 393' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -68.55 160.73 48.09 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.26 1.973 . . . . 0.0 112.59 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 1.5 p -127.59 158.79 36.55 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.835 -179.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -87.05 14.71 7.0 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.266 178.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 31.2 m -141.51 14.51 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.315 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 168.87 61.13 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 114.697 -1.138 . . . . 0.0 109.284 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.495 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 78.3 Cg_exo -41.8 -31.18 1.29 Allowed 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.329 2.686 . . . . 0.0 113.274 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.554 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.6 p-10 -28.39 119.32 0.12 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.803 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.51 150.41 52.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.578 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 1.007 HG23 HG23 ' B' ' 390' ' ' VAL . 0.2 OUTLIER -107.22 150.38 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.303 -179.897 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.721 ' CG2' ' HB1' ' B' ' 423' ' ' ALA . 0.1 OUTLIER -121.75 153.28 25.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.341 -179.818 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.446 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 7.3 mt-10 -123.69 132.77 53.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.856 0.36 . . . . 0.0 110.174 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.579 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -115.84 115.2 25.84 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.44 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.601 ' HB3' HG22 ' B' ' 411' ' ' VAL . 2.1 ptm180 -143.73 -164.19 1.82 Allowed 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.173 0.511 . . . . 0.0 111.486 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.667 HG12 ' CA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -145.44 144.31 21.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.288 -179.401 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 407' ' ' GLY . . . . . 0.484 ' HA3' ' HG2' ' B' ' 384' ' ' ARG . . . -36.21 -29.96 0.02 OUTLIER Glycine 0 C--N 1.331 0.298 0 CA-C-N 115.744 -0.662 . . . . 0.0 113.309 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 408' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' B' ' 406' ' ' VAL . 2.8 t70 -66.08 -8.23 22.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.77 0.319 . . . . 0.0 110.899 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 409' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 86.68 39.88 7.45 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.462 -179.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.514 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 53.1 m -129.05 116.44 19.3 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.601 HG22 ' HB3' ' B' ' 405' ' ' ARG . 48.1 t -86.19 110.95 20.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.887 178.632 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.993 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -64.49 -34.75 78.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.356 . . . . 0.0 110.304 179.742 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.449 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . -176.4 -154.9 12.24 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.677 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.467 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 12.9 t -173.78 168.99 4.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.693 0.283 . . . . 0.0 110.743 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.476 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -167.35 167.46 39.91 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.399 -0.905 . . . . 0.0 113.033 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.18 150.82 18.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 122.276 0.23 . . . . 0.0 110.388 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.855 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -160.26 143.5 9.1 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.927 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.495 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 15.1 ptt180 -56.16 -47.04 79.01 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.839 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.5 OUTLIER -99.75 34.38 2.28 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 178.884 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.723 ' C ' HD12 ' B' ' 420' ' ' ILE . 0.5 OUTLIER 46.35 -46.23 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 N-CA-C 115.506 1.669 . . . . 0.0 115.506 178.609 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.686 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -46.01 -48.17 16.7 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 -179.129 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.855 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -48.52 -40.12 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.719 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.109 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.721 ' HB1' ' CG2' ' B' ' 402' ' ' VAL . . . -63.51 -44.28 94.77 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.363 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.07 -65.22 3.23 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.484 -0.865 . . . . 0.0 111.456 178.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.694 HG23 ' HA ' ' B' ' 367' ' ' ASP . 4.4 mm -52.94 -35.85 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.059 0.456 . . . . 0.0 110.382 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.581 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 3.6 tpt180 -63.45 -49.12 74.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.531 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.525 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -51.71 -41.73 61.7 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.287 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.991 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -58.76 -62.22 2.03 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.31 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.524 ' HA ' HD11 ' B' ' 432' ' ' LEU . 0.3 OUTLIER -53.78 -20.44 5.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.244 179.295 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.469 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 1.9 m-80 -76.1 -40.05 53.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.812 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.423 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -64.62 -39.08 93.07 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.253 0.549 . . . . 0.0 109.579 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.916 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.2 OUTLIER -85.19 8.09 19.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.538 179.008 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.408 ' HB2' ' HA ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -87.85 -1.6 58.08 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.276 -179.759 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.552 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 6.3 m-20 -111.44 83.56 1.79 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.918 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.479 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 1.6 ptmm? -50.75 -49.4 58.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.006 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.479 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 4.2 mmtp -61.36 -45.1 95.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.166 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.993 ' SD ' HD12 ' B' ' 412' ' ' LEU . 2.0 ttp -67.63 -51.45 49.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.939 0.4 . . . . 0.0 110.488 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.916 HD11 ' HA ' ' B' ' 432' ' ' LEU . 80.6 mt -51.13 -62.62 1.5 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.213 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -50.99 -38.72 52.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.317 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.725 ' CZ ' ' NE2' ' B' ' 444' ' ' GLN . 0.9 OUTLIER -55.23 -36.8 66.39 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.7 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.665 ' CB ' HG23 ' B' ' 378' ' ' ILE . 32.1 m-85 -73.36 -46.04 51.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.163 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.416 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -41.88 -51.03 4.42 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -64.09 -42.18 97.03 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.725 ' NE2' ' CZ ' ' B' ' 440' ' ' PHE . 3.4 mm-40 -53.59 -42.51 67.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.168 179.018 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.641 ' CZ ' ' CE1' ' B' ' 380' ' ' TYR . 40.2 mmt-85 . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.624 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.434 ' O ' ' HG2' ' B' ' 371' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.232 0 CA-C-O 120.964 0.412 . . . . 0.0 109.978 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.515 ' N ' ' HE3' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -36.09 -66.7 0.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.617 179.6 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -38.23 -48.87 1.33 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.5 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 1.118 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -60.38 -80.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.245 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.515 ' HE3' ' N ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -33.61 -40.44 0.07 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.99 0.424 . . . . 0.0 110.725 179.761 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.543 ' CZ ' ' HB3' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -57.13 -59.61 4.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.102 179.191 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.521 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.6 OUTLIER -47.62 -49.46 27.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.171 0.51 . . . . 0.0 111.215 179.615 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.537 HD13 ' OH ' ' B' ' 387' ' ' TYR . 0.9 OUTLIER -52.28 -70.51 0.09 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.263 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 375' ' ' TYR . . . . . 0.557 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.5 m-85 -80.72 -48.33 12.7 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -177.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.526 ' CB ' ' HD2' ' B' ' 372' ' ' ARG . 8.2 t -59.88 -26.45 65.88 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 -178.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.802 ' O ' HD13 ' B' ' 378' ' ' ILE . 4.4 mm? -120.63 -25.24 5.56 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -178.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.802 HD13 ' O ' ' B' ' 377' ' ' LEU . 3.1 mm -133.23 35.91 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.557 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -140.97 82.73 0.23 Allowed Glycine 0 C--N 1.33 0.215 0 C-N-CA 120.084 -1.055 . . . . 0.0 113.344 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.561 ' CD2' ' HD3' ' B' ' 445' ' ' ARG . 15.7 p90 -99.39 24.34 8.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.103 0.477 . . . . 0.0 109.872 178.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.532 ' HB3' ' O ' ' B' ' 380' ' ' TYR . . . 80.04 -89.46 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.497 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.442 ' C ' ' O ' ' B' ' 381' ' ' ALA . 55.6 m -33.2 -38.53 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.3 -179.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.574 HD22 HG11 ' B' ' 406' ' ' VAL . 0.7 OUTLIER -41.49 -39.7 1.6 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.9 0.381 . . . . 0.0 110.968 -179.612 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.06 35.87 2.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.42 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.771 ' HA ' HG12 ' B' ' 406' ' ' VAL . 8.9 tt -75.03 123.86 25.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.547 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 24.6 p80 -147.9 147.35 29.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.539 0.685 . . . . 0.0 112.194 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.579 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 4.4 m-85 -92.47 155.43 17.85 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.935 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.36 125.19 53.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 4.3 m -88.72 131.53 34.99 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.597 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 1.061 HG23 HG23 ' B' ' 401' ' ' ILE . 16.3 m -137.16 158.27 35.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.324 0.583 . . . . 0.0 111.454 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.791 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.1 OUTLIER 79.54 64.38 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.361 179.626 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.421 ' HA ' ' HD2' ' B' ' 393' ' ' PRO . 0.4 OUTLIER -39.46 103.79 0.3 Allowed Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.642 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.477 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 1.8 Cg_endo -45.99 165.52 0.07 OUTLIER 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.81 2.34 . . . . 0.0 112.961 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 3.1 p -124.38 162.27 24.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.671 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -85.4 12.44 8.32 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.509 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 20.3 m -141.5 10.0 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.249 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.533 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 0.2 OUTLIER -174.32 51.04 0.1 OUTLIER Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.465 -179.796 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.533 ' CD ' ' N ' ' B' ' 397' ' ' ASP . 95.4 Cg_exo -31.21 -29.52 0.02 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 124.164 3.242 . . . . 0.0 114.105 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.532 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.5 p-10 -37.06 129.38 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.822 0.344 . . . . 0.0 111.0 -179.311 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 28.4 t -143.94 158.56 43.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.237 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 1.061 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -116.25 144.55 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-O 121.182 0.515 . . . . 0.0 111.771 -179.438 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.813 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.0 OUTLIER -127.11 128.67 70.71 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.603 179.951 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.503 ' CG ' ' OG1' ' B' ' 414' ' ' THR . 2.9 mt-10 -110.64 131.49 55.01 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.609 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.579 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 1.4 p -93.63 141.17 28.79 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.78 ' HA ' HD22 ' B' ' 412' ' ' LEU . 0.9 OUTLIER -162.16 -175.28 4.5 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.275 0.56 . . . . 0.0 112.345 -179.552 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.771 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -136.69 145.75 29.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.954 -179.622 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -34.89 -34.44 0.05 OUTLIER Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.654 -0.703 . . . . 0.0 113.742 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -60.82 -12.97 12.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.974 0.416 . . . . 0.0 110.726 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 91.03 36.3 6.75 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.722 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.554 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 18.5 m -118.65 116.46 26.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.538 0.209 . . . . 0.0 111.312 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.502 ' HA ' ' CB ' ' B' ' 405' ' ' ARG . 33.7 t -82.88 96.64 3.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.176 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.78 HD22 ' HA ' ' B' ' 405' ' ' ARG . 0.2 OUTLIER -50.89 -26.16 5.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.963 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.51 ' N ' ' SG ' ' B' ' 404' ' ' CYS . . . -177.44 -177.26 46.17 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 119.462 -1.351 . . . . 0.0 113.954 -179.595 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.791 ' CG2' HD11 ' B' ' 401' ' ' ILE . 6.3 m -148.56 120.08 7.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.28 -0.46 . . . . 0.0 110.469 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.585 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -130.48 163.77 23.11 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.419 -0.895 . . . . 0.0 113.152 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.467 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 3.2 p -135.33 161.06 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.763 -0.218 . . . . 0.0 110.416 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.819 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -155.87 115.61 0.67 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.043 -1.075 . . . . 0.0 113.424 -179.495 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.472 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -44.55 -54.82 5.67 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 122.189 0.196 . . . . 0.0 111.337 179.6 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.85 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.7 OUTLIER -86.98 -5.92 58.93 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.111 178.865 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.85 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.6 OUTLIER 94.46 -45.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 C-N-CA 123.65 0.78 . . . . 0.0 112.262 179.5 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -47.03 -60.56 2.37 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.616 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.819 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -42.26 -32.69 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.509 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.973 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.779 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -68.09 -45.95 72.34 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.146 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.509 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.54 -58.19 12.16 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 119.81 -1.186 . . . . 0.0 111.519 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.691 ' N ' HD13 ' B' ' 425' ' ' ILE . 1.9 mm -59.57 -36.28 64.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.768 0.318 . . . . 0.0 110.744 179.415 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.4 OUTLIER -62.15 -56.03 22.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.063 179.489 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.813 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -45.02 -42.3 8.24 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.017 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 1.118 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -53.62 -66.17 0.44 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.004 178.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.513 ' O ' ' N ' ' B' ' 433' ' ' ARG . 1.1 mt-10 -47.27 -44.37 22.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.687 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.441 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 0.7 OUTLIER -55.87 -29.49 60.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.909 179.685 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.452 ' HB3' HD22 ' B' ' 374' ' ' LEU . . . -72.3 -48.45 42.12 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 120.826 0.346 . . . . 0.0 110.421 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.847 HD13 ' H ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -97.05 13.36 29.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.818 179.437 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -87.07 7.24 28.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.982 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.571 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 2.0 m-20 -117.65 74.65 0.94 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.918 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.435 ' C ' ' O ' ' B' ' 434' ' ' ASP . 14.3 ptmt -36.84 -43.85 0.46 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.499 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.432 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.1 OUTLIER -64.36 -47.92 77.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.397 179.768 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.629 ' SD ' HD12 ' B' ' 412' ' ' LEU . 2.0 ttp -60.79 -51.46 69.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.416 179.482 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.681 HD11 ' HB2' ' B' ' 432' ' ' LEU . 60.0 mt -58.0 -57.78 11.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.592 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -53.02 -30.42 35.28 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.914 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.466 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.6 OUTLIER -66.38 -40.85 89.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.501 179.191 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.572 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 42.9 m-85 -75.12 -49.49 19.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.812 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -41.48 -46.32 3.44 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -38.88 81.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.355 178.387 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.572 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -60.08 -26.78 66.44 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.119 179.122 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.561 ' HD3' ' CD2' ' B' ' 380' ' ' TYR . 1.4 mmm180 . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.563 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.478 ' HB2' ' NZ ' ' B' ' 371' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.929 0.395 . . . . 0.0 110.667 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.503 ' HA ' ' CD ' ' B' ' 371' ' ' LYS . 4.2 tmm? -39.58 -46.36 1.76 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.666 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -56.45 -52.75 63.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.411 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.895 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -50.9 -69.78 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.022 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.503 ' CD ' ' HA ' ' B' ' 368' ' ' MET . 5.1 mttp -31.36 -53.71 0.23 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.124 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.535 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.7 ttt-85 -51.59 -45.92 63.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.553 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.604 ' NE2' ' HG ' ' B' ' 377' ' ' LEU . 1.6 tm0? -57.14 -47.02 82.18 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.173 0.511 . . . . 0.0 110.737 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.608 HD23 ' N ' ' B' ' 374' ' ' LEU . 3.6 mt -53.91 -68.57 0.17 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -179.055 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -85.73 -42.21 14.44 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -177.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.7 OUTLIER -67.84 -27.94 67.13 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.218 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.684 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.3 OUTLIER -106.32 -31.34 8.66 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.773 0.32 . . . . 0.0 110.765 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.748 HG22 HD22 ' B' ' 383' ' ' LEU . 1.3 mm -137.24 -148.08 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.529 ' H ' HG22 ' B' ' 378' ' ' ILE . . . 28.73 72.83 0.04 OUTLIER Glycine 0 C--N 1.332 0.359 0 C-N-CA 121.23 -0.509 . . . . 0.0 113.45 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.637 ' CE1' HD13 ' B' ' 383' ' ' LEU . 10.4 p90 -89.93 -55.41 3.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.662 0.268 . . . . 0.0 111.116 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -176.69 -48.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.817 0.342 . . . . 0.0 111.366 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.48 16.65 4.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.124 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.748 HD22 HG22 ' B' ' 378' ' ' ILE . 2.9 tp -103.21 -27.77 12.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.028 0.442 . . . . 0.0 110.807 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 8.0 tpp85 62.32 15.71 7.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.971 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.681 ' HA ' HG12 ' B' ' 406' ' ' VAL . 6.5 tt -48.02 128.74 14.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.702 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -158.59 136.95 10.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.304 0.573 . . . . 0.0 112.25 -179.639 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.582 ' CZ ' ' HB3' ' B' ' 404' ' ' CYS . 6.9 m-85 -87.86 162.93 16.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.578 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.591 HG23 ' O ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -138.35 147.58 25.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.97 178.498 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 389' ' ' THR . . . . . 0.446 HG22 ' O ' ' B' ' 389' ' ' THR . 1.0 OUTLIER -112.12 109.94 19.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 0.0 110.668 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.956 HG23 HG23 ' B' ' 401' ' ' ILE . 29.7 m -112.51 155.13 13.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.559 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.634 ' HB3' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 67.68 69.38 0.35 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.413 -179.665 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.424 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 17.0 mmtt -54.56 149.27 21.88 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.097 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.511 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 11.2 Cg_exo -72.55 165.06 33.8 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 123.081 2.521 . . . . 0.0 112.526 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.471 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 1.2 p -156.47 165.84 35.14 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.498 179.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -79.37 4.78 14.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.846 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 396' ' ' VAL . . . . . 0.582 HG23 ' OD2' ' B' ' 397' ' ' ASP . 6.1 m -130.99 17.06 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.292 0.568 . . . . 0.0 109.558 178.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.582 ' OD2' HG23 ' B' ' 396' ' ' VAL . 2.8 p30 166.02 60.42 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.967 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.511 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 96.3 Cg_exo -39.4 -54.72 1.76 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.045 2.497 . . . . 0.0 112.934 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.494 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 18.3 p30 -21.65 137.01 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.402 -178.558 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -143.69 141.53 30.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.973 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.956 HG23 HG23 ' B' ' 390' ' ' VAL . 0.1 OUTLIER -111.16 139.0 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 CA-C-O 121.465 0.65 . . . . 0.0 111.776 -179.055 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.781 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -102.27 176.65 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.055 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.591 ' O ' HG23 ' B' ' 388' ' ' VAL . 4.9 mt-10 -156.2 106.98 2.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.984 0.421 . . . . 0.0 110.833 179.297 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.582 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -88.64 128.45 35.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.482 ' HA ' ' O ' ' B' ' 410' ' ' THR . 12.5 ptt180 -155.19 173.09 17.11 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.642 -179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.681 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -132.81 132.59 59.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.87 -179.249 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 407' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' B' ' 406' ' ' VAL . . . -30.95 -32.14 0.01 OUTLIER Glycine 0 C--N 1.333 0.407 0 O-C-N 123.436 0.46 . . . . 0.0 113.555 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 408' ' ' ASP . . . . . 0.545 ' N ' ' O ' ' B' ' 406' ' ' VAL . 21.4 t0 -57.17 -16.42 7.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.014 0.435 . . . . 0.0 110.387 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 409' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 95.72 35.86 5.49 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.785 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.482 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 16.9 m -128.28 124.79 37.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.082 0.468 . . . . 0.0 111.737 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.489 HG13 ' O ' ' B' ' 404' ' ' CYS . 47.9 t -89.2 89.43 3.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.525 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.643 HD12 ' CE ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -46.01 -26.44 0.73 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.897 0.38 . . . . 0.0 110.23 -179.928 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.46 ' O ' HG12 ' B' ' 411' ' ' VAL . . . 177.61 -173.77 46.37 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.858 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.467 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 3.4 t -160.64 171.37 19.03 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.667 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -173.01 170.41 43.56 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 118.525 -1.798 . . . . 0.0 114.836 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.526 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 5.2 p -136.76 152.05 28.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.321 -0.439 . . . . 0.0 110.209 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.809 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -153.66 111.54 0.49 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.904 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -42.05 -56.77 2.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.739 0.304 . . . . 0.0 110.923 179.706 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.893 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.1 OUTLIER -82.7 -11.27 58.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.248 179.151 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.893 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 97.12 -44.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.249 0 C-N-CA 123.873 0.869 . . . . 0.0 111.903 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.506 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.5 OUTLIER -48.08 -59.31 3.48 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.534 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.809 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -41.86 -31.42 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 177.845 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.793 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -71.65 -45.33 62.34 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.687 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.11 -59.9 9.27 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 119.906 -1.14 . . . . 0.0 111.702 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.736 ' N ' HD13 ' B' ' 425' ' ' ILE . 1.2 mm -57.84 -51.23 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.89 0.376 . . . . 0.0 110.797 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.567 ' HG2' ' HA3' ' B' ' 415' ' ' GLY . 0.0 OUTLIER -46.37 -51.17 15.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.237 179.687 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.588 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -51.1 -54.15 27.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.807 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.895 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -51.94 -65.5 0.55 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.253 0.549 . . . . 0.0 110.639 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.664 ' HA ' HD21 ' B' ' 432' ' ' LEU . 55.9 mt-10 -52.87 -19.52 2.61 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.443 179.505 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.485 ' ND2' ' HG3' ' B' ' 426' ' ' ARG . 0.8 OUTLIER -77.97 -32.47 51.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.34 -179.795 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.3 -42.53 44.96 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.345 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.964 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -87.33 14.48 7.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.759 179.807 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.495 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 8.2 ttt85 -88.01 4.65 44.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.67 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.564 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 12.7 m-20 -116.07 72.37 0.81 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.074 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' B' ' 436' ' ' LYS . 15.2 ptpt -41.69 -47.33 3.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.686 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.518 ' N ' ' HG3' ' B' ' 435' ' ' LYS . 1.7 mmmm -58.4 -47.63 83.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.146 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.643 ' CE ' HD12 ' B' ' 412' ' ' LEU . 13.2 tmm? -65.79 -54.7 23.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.012 0.434 . . . . 0.0 109.864 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.964 HD11 ' HA ' ' B' ' 432' ' ' LEU . 99.2 mt -51.61 -68.07 0.2 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.221 179.098 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -44.41 -36.2 2.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.859 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.633 ' CE2' ' CE1' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -60.98 -41.91 97.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.26 0.552 . . . . 0.0 109.639 179.692 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.633 ' CE1' ' CE2' ' B' ' 440' ' ' PHE . 40.9 m-85 -75.54 -33.7 60.7 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.545 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.81 -46.1 64.14 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.93 -45.62 77.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.479 178.705 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.583 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -57.99 -25.92 61.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.306 179.376 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.577 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.434 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.472 ' N ' ' OD1' ' B' ' 367' ' ' ASP . 0.5 OUTLIER . . . . . 0 C--O 1.233 0.226 0 CA-C-O 120.774 0.321 . . . . 0.0 110.4 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.545 ' HA ' ' CG ' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -37.49 -44.75 0.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.54 -179.846 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 369' ' ' ASN . . . . . 0.498 ' O ' ' HB2' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -52.1 -57.97 7.96 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.057 0.456 . . . . 0.0 110.337 178.912 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.941 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -57.66 -72.51 0.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.622 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.545 ' CG ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -36.04 -31.92 0.03 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.977 0.418 . . . . 0.0 110.21 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.581 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.1 OUTLIER -65.42 -54.02 34.7 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.56 178.894 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.709 ' HG2' HD22 ' B' ' 377' ' ' LEU . 0.0 OUTLIER -53.73 -37.89 63.8 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.367 0.603 . . . . 0.0 110.328 179.017 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.543 HD23 ' N ' ' B' ' 374' ' ' LEU . 2.9 mt -64.56 -79.37 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -178.773 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -85.47 12.42 8.49 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.581 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -127.2 -15.38 5.24 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.686 -0.406 . . . . 0.0 111.741 179.805 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 1.053 ' O ' HD13 ' B' ' 378' ' ' ILE . 9.0 mp -124.98 -21.77 4.62 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.808 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 1.053 HD13 ' O ' ' B' ' 377' ' ' LEU . 12.1 mm -137.41 -72.39 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.619 ' HA2' HD13 ' B' ' 383' ' ' LEU . . . -47.14 79.45 0.0 OUTLIER Glycine 0 CA--C 1.52 0.37 0 CA-C-N 116.201 -0.454 . . . . 0.0 113.807 -179.149 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.591 ' CD2' HD12 ' B' ' 383' ' ' LEU . 45.3 p90 -76.9 -161.07 0.18 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.649 0.261 . . . . 0.0 111.058 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.553 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -84.7 105.73 15.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.693 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.553 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.1 t 91.22 47.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.719 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.78 HD23 ' O ' ' B' ' 383' ' ' LEU . 4.5 tt -101.93 -23.21 14.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.889 0.376 . . . . 0.0 110.276 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.493 ' O ' ' ND1' ' B' ' 386' ' ' HIS . 13.7 tpt180 81.28 5.0 1.4 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.354 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.603 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 6.1 tt -57.13 135.23 56.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.945 0.403 . . . . 0.0 110.376 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.529 ' N ' HD23 ' B' ' 385' ' ' LEU . 18.3 p-80 -167.05 147.41 5.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.405 0.621 . . . . 0.0 112.375 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.531 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 4.1 m-85 -98.85 138.66 35.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.385 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.515 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -118.01 118.77 59.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.298 0.57 . . . . 0.0 110.629 179.272 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 53.9 m -78.64 129.19 34.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.982 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 1.003 HG23 HG23 ' B' ' 401' ' ' ILE . 27.3 m -136.71 154.29 31.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.666 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.707 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 84.88 49.27 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.354 -179.539 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.444 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER -29.76 109.44 0.25 Allowed Pre-proline 0 N--CA 1.462 0.144 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.33 -179.433 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.459 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 1.9 Cg_endo -48.01 158.54 0.84 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 122.816 2.344 . . . . 0.0 113.422 -179.172 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.509 ' HG1' ' CG ' ' B' ' 397' ' ' ASP . 40.2 p -124.69 165.01 18.69 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.729 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -88.63 15.8 7.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.802 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 396' ' ' VAL . . . . . 0.574 ' O ' ' CG2' ' B' ' 396' ' ' VAL . 0.2 OUTLIER -141.6 9.56 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.937 0.875 . . . . 0.0 109.909 179.51 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.509 ' CG ' ' HG1' ' B' ' 394' ' ' THR . 3.5 p-10 171.22 59.12 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.543 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.481 ' O ' ' C ' ' B' ' 399' ' ' ASN . 5.2 Cg_exo -39.34 -31.55 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 123.611 2.874 . . . . 0.0 112.412 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.511 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 13.9 m120 -25.38 109.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.568 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 400' ' ' SER . . . . . 0.409 ' O ' HG23 ' B' ' 416' ' ' VAL . 12.9 m -127.92 162.53 26.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.605 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 1.003 HG23 HG23 ' B' ' 390' ' ' VAL . 0.6 OUTLIER -119.78 151.01 22.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.517 -179.882 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.726 ' CG2' ' HB1' ' B' ' 423' ' ' ALA . 0.1 OUTLIER -120.27 154.3 23.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.515 ' CB ' HG23 ' B' ' 388' ' ' VAL . 13.6 mm-40 -122.81 130.15 52.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.809 0.338 . . . . 0.0 110.685 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.532 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.5 OUTLIER -112.43 112.67 24.39 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.842 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.52 ' CG ' ' N ' ' B' ' 406' ' ' VAL . 0.1 OUTLIER -138.64 -166.33 1.99 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 121.349 0.595 . . . . 0.0 111.888 -178.823 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.753 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -157.79 140.4 6.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.328 -179.354 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 407' ' ' GLY . . . . . 0.46 ' HA2' ' HG2' ' B' ' 384' ' ' ARG . . . 64.78 6.73 25.24 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.551 -0.833 . . . . 0.0 111.322 -178.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 20.6 t70 72.41 35.45 1.17 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.685 0.279 . . . . 0.0 111.11 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -155.73 -49.46 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.497 -0.858 . . . . 0.0 113.22 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.753 ' HB ' HG23 ' B' ' 406' ' ' VAL . 53.4 m -82.12 105.65 13.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.681 0.277 . . . . 0.0 111.68 -179.4 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.408 ' CG1' ' OE1' ' B' ' 403' ' ' GLU . 79.1 t -90.06 111.07 22.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.651 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.889 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -64.65 -35.23 80.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.313 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.462 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 175.76 -148.68 9.5 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.561 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.501 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 8.7 t -168.53 166.84 11.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.776 0.322 . . . . 0.0 111.301 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.576 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -154.8 136.87 5.38 Favored Glycine 0 C--O 1.228 -0.259 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.679 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.535 ' HB ' HD12 ' B' ' 401' ' ' ILE . 8.4 p -122.69 149.19 26.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.893 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -163.63 151.88 21.57 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.135 -1.031 . . . . 0.0 113.24 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.481 ' HG3' ' OD1' ' B' ' 419' ' ' ASN . 0.6 OUTLIER -62.83 -45.45 92.56 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.359 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.842 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.5 OUTLIER -100.02 32.19 3.03 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.892 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.668 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 47.42 -44.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 178.499 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.623 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -47.88 -45.46 30.45 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 119.12 0.873 . . . . 0.0 108.93 -179.219 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.893 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -49.95 -40.55 16.68 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.785 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 177.873 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.726 ' HB1' ' CG2' ' B' ' 402' ' ' VAL . . . -62.2 -46.04 90.66 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.492 178.347 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.49 -70.03 1.13 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.404 -0.903 . . . . 0.0 111.604 178.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.471 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 0.5 OUTLIER -50.92 -33.47 12.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.315 179.284 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.586 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 1.5 tpt180 -63.76 -57.89 8.56 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.513 179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.616 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -42.97 -39.59 2.66 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.238 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.941 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -60.29 -60.46 3.78 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.219 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.542 ' O ' HD22 ' B' ' 432' ' ' LEU . 32.2 mt-10 -47.66 -21.28 0.35 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.281 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.501 ' ND2' ' O ' ' B' ' 414' ' ' THR . 1.7 m-80 -81.57 -36.48 29.01 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.741 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.455 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -63.62 -38.38 90.91 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.161 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.685 HD13 ' O ' ' B' ' 428' ' ' ALA . 0.0 OUTLIER -94.08 11.68 29.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.991 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 0.9 OUTLIER -92.8 4.62 53.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.142 -179.79 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.544 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 15.6 m-20 -119.31 92.14 3.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 0.0 110.85 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.438 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -56.38 -46.43 80.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.476 -179.635 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.438 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -60.61 -42.14 96.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.943 0.401 . . . . 0.0 110.548 -179.8 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.889 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -71.37 -46.49 60.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.164 179.442 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.55 HD11 ' HA ' ' B' ' 432' ' ' LEU . 54.5 mt -56.12 -65.41 0.61 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.115 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -51.16 -36.48 41.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.97 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.466 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.9 OUTLIER -53.55 -44.42 69.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.67 179.642 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.788 ' CB ' HG23 ' B' ' 378' ' ' ILE . 43.0 m-85 -65.16 -49.47 69.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.539 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.412 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -39.24 -51.19 1.99 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -38.81 92.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.979 178.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.517 ' N ' ' O ' ' B' ' 441' ' ' TYR . 9.0 mt-30 -64.6 -36.76 85.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.044 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.501 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.159 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.57 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.519 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.482 ' O ' ' HB2' ' B' ' 372' ' ' ARG . 1.7 ttp -36.17 -43.0 0.33 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.509 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -64.27 -43.27 95.34 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.85 0.357 . . . . 0.0 110.681 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.979 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -65.75 -74.87 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.438 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.482 ' HD2' ' HB2' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -33.92 -46.18 0.22 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.104 0.478 . . . . 0.0 110.571 179.826 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.492 ' O ' ' HB3' ' B' ' 376' ' ' SER . 9.5 ttp85 -60.44 -45.85 92.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.004 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.2 OUTLIER -60.17 -53.15 61.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.0 -179.244 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.714 HD23 ' N ' ' B' ' 374' ' ' LEU . 0.3 OUTLIER -56.74 -64.13 0.97 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -178.448 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 375' ' ' TYR . . . . . 0.538 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.3 m-85 -78.26 -52.09 9.17 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -177.478 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.492 ' HB3' ' O ' ' B' ' 372' ' ' ARG . 1.3 t -69.05 -29.15 67.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.877 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.9 OUTLIER -102.89 -35.53 8.56 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.665 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.877 HD13 ' O ' ' B' ' 377' ' ' LEU . 8.1 mm -136.01 37.44 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.538 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -121.61 81.13 0.34 Allowed Glycine 0 CA--C 1.517 0.207 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.8 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 1.1 ' CE2' HD12 ' B' ' 383' ' ' LEU . 36.1 p90 -105.11 174.37 5.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.887 0.375 . . . . 0.0 110.812 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -80.07 82.17 6.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.15 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.508 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 0.6 OUTLIER 160.71 -31.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.162 179.792 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 1.1 HD12 ' CE2' ' B' ' 380' ' ' TYR . 0.2 OUTLIER -54.21 -54.97 32.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.925 0.393 . . . . 0.0 110.468 179.784 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' B' ' 385' ' ' LEU . 5.4 tpt180 76.28 46.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.414 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.845 ' HA ' HG12 ' B' ' 406' ' ' VAL . 3.0 mt -38.82 140.22 0.38 Allowed 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -140.8 89.27 2.25 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -177.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.683 ' HE1' HD22 ' B' ' 385' ' ' LEU . 39.7 m-85 -91.87 122.76 34.7 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 177.371 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -114.83 118.16 57.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.396 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 8.4 m -83.81 110.16 18.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.657 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.811 HG23 HG23 ' B' ' 401' ' ' ILE . 35.9 m -115.92 149.93 18.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.16 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.657 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 88.68 58.54 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.077 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.448 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 0.0 OUTLIER -38.13 142.89 0.44 Allowed Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.507 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' B' ' 392' ' ' LYS . 7.0 Cg_exo -71.37 158.76 53.5 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.181 1.921 . . . . 0.0 113.019 -178.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.455 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 34.8 p -129.62 161.02 31.51 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.355 -179.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -85.32 14.26 5.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.563 179.319 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 4.7 m -136.89 9.26 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.886 178.298 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.402 ' CG ' ' OD1' ' B' ' 399' ' ' ASN . 0.2 OUTLIER 168.7 62.94 0.01 OUTLIER Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.785 -179.483 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.455 ' HA ' ' H ' ' B' ' 394' ' ' THR . 1.6 Cg_endo -42.08 -35.71 3.44 Favored 'Trans proline' 0 N--CA 1.464 -0.225 0 C-N-CA 123.687 2.925 . . . . 0.0 112.572 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.539 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.2 p-10 -29.01 121.12 0.13 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.041 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 1.3 t -131.42 162.5 30.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.053 179.521 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.811 HG23 HG23 ' B' ' 390' ' ' VAL . 0.0 OUTLIER -120.42 155.87 23.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.963 0.411 . . . . 0.0 111.501 -179.423 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.757 ' N ' HD13 ' B' ' 401' ' ' ILE . 0.1 OUTLIER -126.45 139.73 50.84 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.831 -179.591 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 403' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -102.26 119.86 39.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.939 0.399 . . . . 0.0 110.476 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.658 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 5.6 t -92.22 95.35 9.67 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.754 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.513 ' HA ' ' O ' ' B' ' 410' ' ' THR . 35.3 ttp180 -129.16 162.27 28.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.461 -178.447 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.845 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -139.64 144.56 28.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.074 -179.657 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 55.97 14.0 7.36 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.298 -0.953 . . . . 0.0 111.296 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 13.1 t70 57.51 23.01 8.67 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 120.801 0.334 . . . . 0.0 110.288 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -139.96 -0.71 1.92 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.238 -0.982 . . . . 0.0 113.703 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.675 ' HB ' HG23 ' B' ' 406' ' ' VAL . 23.3 m -142.83 117.59 9.87 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 117.237 0.518 . . . . 0.0 111.759 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.484 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 73.4 t -95.55 108.51 21.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.589 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.794 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -63.06 -37.2 86.24 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.85 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 175.21 -139.93 5.01 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.213 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.684 ' OG1' HD11 ' B' ' 401' ' ' ILE . 3.0 t -170.12 168.48 8.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.684 0.278 . . . . 0.0 110.854 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.648 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -159.99 131.84 2.8 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.497 -0.858 . . . . 0.0 112.424 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.463 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 7.7 p -119.15 146.05 24.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.873 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -154.53 144.37 11.08 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.057 -1.068 . . . . 0.0 112.992 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.452 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 5.5 ptm180 -57.01 -45.87 82.73 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.846 0.355 . . . . 0.0 111.69 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.808 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -99.34 29.41 3.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.274 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.767 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.5 OUTLIER 50.74 -45.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 179.133 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.629 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -45.24 -56.73 4.55 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 118.884 0.765 . . . . 0.0 109.247 179.884 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.873 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -42.01 -33.77 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 177.882 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.767 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -67.82 -48.62 65.72 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.047 -0.979 . . . . 0.0 109.781 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -60.9 -58.8 11.9 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 119.866 -1.159 . . . . 0.0 111.345 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.602 ' H ' HD12 ' B' ' 425' ' ' ILE . 3.4 mp -56.27 -39.55 60.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.503 179.152 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.576 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.8 tpt180 -61.84 -52.31 64.69 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.342 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.644 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -45.6 -42.01 10.7 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.979 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -60.28 -58.18 9.62 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.521 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.581 ' O ' ' CD2' ' B' ' 432' ' ' LEU . 2.9 tm-20 -52.92 -17.18 1.28 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.552 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.504 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 1.4 m-80 -81.02 -38.92 26.66 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.096 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.658 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -62.61 -45.26 93.68 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.916 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.816 ' C ' HD23 ' B' ' 432' ' ' LEU . 0.1 OUTLIER -83.29 1.86 38.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.756 179.455 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.784 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.2 OUTLIER -78.83 6.94 7.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.213 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.574 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 84.4 m-20 -130.12 83.76 2.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.89 0.376 . . . . 0.0 111.379 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.579 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.2 OUTLIER -48.27 -53.97 15.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.514 179.682 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.579 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 3.5 mmpt? -54.4 -42.21 70.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.555 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.794 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.3 OUTLIER -70.59 -34.55 72.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.805 179.21 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.592 HD22 HG13 ' B' ' 378' ' ' ILE . 7.2 mt -65.62 -63.96 0.97 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 439' ' ' ASP . . . . . 0.418 ' O ' ' HB3' ' B' ' 442' ' ' ALA . 44.6 t0 -54.79 -26.9 37.67 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.473 ' HB3' ' O ' ' B' ' 437' ' ' MET . 2.7 t80 -61.55 -44.0 97.83 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.499 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.42 ' CE2' ' HG2' ' B' ' 437' ' ' MET . 49.7 m-85 -69.86 -26.67 64.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.18 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' B' ' 439' ' ' ASP . . . -59.69 -48.77 80.34 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -63.36 -41.93 98.87 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.768 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 444' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.48 -34.5 76.96 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.115 0.483 . . . . 0.0 109.808 178.857 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.618 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.005 179.144 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.639 ' O ' ' HB3' ' B' ' 370' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.47 0.561 0 CA-C-O 120.814 0.34 . . . . 0.0 111.703 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.486 ' O ' ' HG3' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -44.36 -62.36 1.2 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.017 179.23 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -53.23 -32.95 50.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.37 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.791 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -58.0 -81.56 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.463 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.486 ' HG3' ' O ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -37.33 -44.82 0.63 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.129 0.49 . . . . 0.0 110.175 179.519 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.543 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.7 OUTLIER -57.26 -47.32 81.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.47 179.343 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.542 ' NE2' ' HG ' ' B' ' 377' ' ' LEU . 0.1 OUTLIER -57.71 -44.15 85.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.147 0.498 . . . . 0.0 111.159 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.753 HD23 ' N ' ' B' ' 374' ' ' LEU . 0.6 OUTLIER -59.16 -70.13 0.17 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -178.393 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 375' ' ' TYR . . . . . 0.469 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.0 m-85 -83.36 -32.34 26.28 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -177.416 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -81.56 -24.79 36.32 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -178.913 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.844 ' O ' HD13 ' B' ' 378' ' ' ILE . 2.4 mm? -117.3 -18.96 9.78 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.844 HD13 ' O ' ' B' ' 377' ' ' LEU . 1.6 mm -144.12 44.99 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.832 0.349 . . . . 0.0 111.342 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.469 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -165.43 60.56 0.24 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.692 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.62 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 22.3 p90 -63.45 -56.98 11.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.776 0.322 . . . . 0.0 110.512 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.62 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 166.7 31.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.986 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.411 ' HB3' ' CE2' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -169.81 28.85 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.856 0.36 . . . . 0.0 110.981 179.806 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.574 ' O ' ' N ' ' B' ' 385' ' ' LEU . 0.2 OUTLIER -108.12 20.34 18.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.459 179.803 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.47 ' HB3' ' HA3' ' B' ' 407' ' ' GLY . 0.6 OUTLIER 26.49 37.58 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 O-C-N 123.786 0.679 . . . . 0.0 111.689 179.597 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.863 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.5 OUTLIER -67.17 130.86 44.45 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.948 0.404 . . . . 0.0 110.544 -179.805 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.577 ' CD2' ' O ' ' B' ' 386' ' ' HIS . 5.4 p-80 -167.7 133.23 1.97 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.316 0.579 . . . . 0.0 112.194 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.918 ' CE2' ' HB1' ' B' ' 427' ' ' ALA . 34.4 m-85 -85.71 -177.25 6.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.033 178.437 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.542 HG23 ' O ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -160.42 111.51 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.3 0.572 . . . . 0.0 111.358 178.286 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.9 m -74.61 116.13 14.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.954 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.821 HG23 HG23 ' B' ' 401' ' ' ILE . 23.9 m -126.1 151.16 32.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.582 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.532 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 79.42 49.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.474 -179.673 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.442 ' C ' ' O ' ' B' ' 391' ' ' LYS . 36.1 mttt -32.3 127.33 0.35 Allowed Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.11 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.605 ' O ' HG22 ' B' ' 394' ' ' THR . 12.3 Cg_endo -56.8 -170.77 0.03 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.723 2.282 . . . . 0.0 112.064 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.605 HG22 ' O ' ' B' ' 393' ' ' PRO . 0.1 OUTLIER -168.33 168.3 11.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.001 -179.906 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -71.6 -10.22 59.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.923 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 33.5 m -128.28 12.87 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 CA-C-O 121.378 0.609 . . . . 0.0 110.104 178.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.574 ' HB3' HG23 ' B' ' 394' ' ' THR . 0.2 OUTLIER -164.24 56.68 0.52 Allowed Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.913 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.571 ' HD3' ' N ' ' B' ' 397' ' ' ASP . 50.2 Cg_exo -53.75 -19.19 14.01 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.093 2.529 . . . . 0.0 113.166 -179.243 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.569 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 43.9 p-10 -65.09 139.57 58.73 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 121.301 0.572 . . . . 0.0 111.474 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 400' ' ' SER . . . . . 0.549 ' O ' ' HA ' ' B' ' 416' ' ' VAL . 17.6 t -137.41 161.08 37.28 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.771 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.869 HD13 ' HB ' ' B' ' 416' ' ' VAL . 4.8 tp -128.79 113.04 27.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 121.18 0.514 . . . . 0.0 111.243 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.915 ' O ' HG22 ' B' ' 414' ' ' THR . 1.9 t -79.3 164.31 3.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.846 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.542 ' O ' HG23 ' B' ' 388' ' ' VAL . 1.3 mm-40 -133.23 106.36 7.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.174 0.511 . . . . 0.0 110.812 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.543 ' SG ' ' CE2' ' B' ' 387' ' ' TYR . 2.0 t -85.9 108.59 18.23 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.481 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -140.26 151.7 45.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.072 0.463 . . . . 0.0 111.375 -179.379 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.863 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -123.35 126.78 73.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.512 -179.248 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 407' ' ' GLY . . . . . 0.47 ' HA3' ' HB3' ' B' ' 384' ' ' ARG . . . -28.52 -35.67 0.01 OUTLIER Glycine 0 C--N 1.331 0.277 0 CA-C-N 115.652 -0.704 . . . . 0.0 113.758 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 408' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' B' ' 406' ' ' VAL . 58.9 t0 -53.36 -20.98 5.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.231 0.539 . . . . 0.0 110.151 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 101.8 42.88 2.2 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.081 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.583 HG22 HD13 ' B' ' 412' ' ' LEU . 13.9 m -137.79 133.24 33.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.921 0.391 . . . . 0.0 111.774 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.475 ' HA ' ' O ' ' B' ' 404' ' ' CYS . 42.9 t -94.63 88.13 2.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.61 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.838 HD12 ' HG3' ' B' ' 437' ' ' MET . 0.1 OUTLIER -51.47 -13.63 0.24 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.316 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.429 ' N ' ' HB3' ' B' ' 404' ' ' CYS . . . 153.51 -165.65 31.5 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 119.62 -1.276 . . . . 0.0 113.39 178.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.915 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -142.27 173.77 11.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.75 0.31 . . . . 0.0 110.563 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.712 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -146.61 98.9 0.2 Allowed Glycine 0 C--O 1.225 -0.416 0 C-N-CA 120.324 -0.941 . . . . 0.0 112.626 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.869 ' HB ' HD13 ' B' ' 401' ' ' ILE . 13.5 p -105.45 157.46 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.893 0.347 . . . . 0.0 110.193 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.788 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . 166.63 138.13 2.37 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 119.422 -1.37 . . . . 0.0 113.496 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.541 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.1 OUTLIER -47.09 -67.41 0.28 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.005 0.431 . . . . 0.0 109.957 179.403 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.784 ' O ' ' N ' ' B' ' 421' ' ' LYS . 2.0 p30 -85.01 91.81 8.18 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 176.244 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.817 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.9 OUTLIER -17.74 -31.5 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -177.411 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.784 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.6 OUTLIER -44.83 -57.05 3.99 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.831 179.011 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.788 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.2 OUTLIER -44.98 -39.44 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.569 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.579 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.817 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -63.35 -37.6 87.9 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.827 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -70.31 -65.48 2.51 Favored Glycine 0 C--N 1.334 0.45 0 C-N-CA 120.206 -0.997 . . . . 0.0 111.724 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.481 ' H ' HD12 ' B' ' 425' ' ' ILE . 3.1 mp -53.76 -35.39 26.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.228 179.252 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.578 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 1.7 tpt180 -61.59 -53.27 58.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.002 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.918 ' HB1' ' CE2' ' B' ' 387' ' ' TYR . . . -45.51 -45.88 13.57 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.916 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.791 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -56.54 -72.39 0.08 Allowed 'General case' 0 C--O 1.238 0.467 0 CA-C-O 121.147 0.499 . . . . 0.0 110.216 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.542 ' HA ' HD21 ' B' ' 432' ' ' LEU . 19.9 mt-10 -45.61 -25.77 0.51 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.026 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.474 ' ND2' ' HD2' ' B' ' 426' ' ' ARG . 1.3 m-80 -72.33 -34.22 67.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.218 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.682 ' HB3' HD22 ' B' ' 374' ' ' LEU . . . -65.83 -43.96 86.98 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.451 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.886 ' CA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -101.42 25.93 7.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.021 0.439 . . . . 0.0 110.645 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.515 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 20.3 ttt180 -94.4 -9.84 34.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.07 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.444 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 3.6 m-20 -109.29 95.13 5.42 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.786 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.546 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 2.5 ptmt -56.33 -31.64 63.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.5 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.546 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 5.9 mtpt -66.15 -54.86 20.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.525 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.838 ' HG3' HD12 ' B' ' 412' ' ' LEU . 17.5 tmm? -63.86 -46.94 82.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.299 179.416 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.886 HD11 ' CA ' ' B' ' 432' ' ' LEU . 71.4 mt -55.24 -59.05 5.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.961 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -64.49 -24.68 67.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.678 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.602 ' CE2' ' CZ ' ' B' ' 441' ' ' TYR . 0.1 OUTLIER -62.28 -47.29 84.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.134 0.493 . . . . 0.0 109.783 179.561 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.602 ' CZ ' ' CE2' ' B' ' 440' ' ' PHE . 64.9 m-85 -76.94 -41.51 42.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.153 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -44.01 -45.19 7.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.97 -45.67 66.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.288 178.547 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.554 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -52.32 -24.52 7.66 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.652 178.86 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.573 ' HD3' ' CD1' ' B' ' 380' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.04 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.172 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.474 ' HA ' ' NZ ' ' B' ' 371' ' ' LYS . 2.1 ttp -36.2 -52.67 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.355 179.352 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -61.46 -42.0 98.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.161 179.387 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 1.006 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -65.41 -83.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.943 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.485 ' C ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -26.67 -49.91 0.04 OUTLIER 'General case' 0 C--O 1.235 0.301 0 O-C-N 123.428 0.455 . . . . 0.0 111.053 179.769 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.476 ' O ' ' HB2' ' B' ' 376' ' ' SER . 35.7 ttp85 -54.08 -61.97 1.96 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.359 179.168 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.575 ' HG2' HD22 ' B' ' 377' ' ' LEU . 0.0 OUTLIER -47.61 -54.53 11.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 111.09 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.469 HD11 ' CB ' ' B' ' 428' ' ' ALA . 7.7 mt -42.86 -67.85 0.24 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -178.698 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 375' ' ' TYR . . . . . 0.536 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-30 -93.16 -48.3 6.53 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.601 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.476 ' HB2' ' O ' ' B' ' 372' ' ' ARG . 11.9 m -60.61 -13.94 17.37 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 121.259 -0.176 . . . . 0.0 111.338 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.778 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.9 OUTLIER -125.43 -29.12 3.26 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.235 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.778 HD13 ' O ' ' B' ' 377' ' ' LEU . 6.8 mm -142.88 44.2 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -178.726 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.536 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -142.48 74.77 0.33 Allowed Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.719 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.56 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 0.1 OUTLIER -100.41 -76.67 0.55 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.745 0.307 . . . . 0.0 110.803 179.876 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.56 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 168.1 82.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.008 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 25.1 t 176.58 -69.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.618 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.645 HD23 ' N ' ' B' ' 383' ' ' LEU . 1.6 pt? -41.99 -28.15 0.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.822 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' B' ' 407' ' ' GLY . 0.7 OUTLIER 62.93 53.27 2.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.748 -179.721 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.82 ' HG ' HG12 ' B' ' 406' ' ' VAL . 6.1 tt -76.7 127.6 33.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.664 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.52 ' N ' HD23 ' B' ' 385' ' ' LEU . 14.3 p-80 -152.07 140.83 20.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.52 0.676 . . . . 0.0 112.366 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.504 ' OH ' ' HA ' ' B' ' 428' ' ' ALA . 40.5 m-85 -91.89 160.65 15.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.869 179.347 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.66 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -136.97 138.25 46.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.118 179.067 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 389' ' ' THR . . . . . 0.525 ' CG2' ' O ' ' B' ' 389' ' ' THR . 0.4 OUTLIER -100.08 113.49 26.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.708 -179.786 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.987 HG23 HG23 ' B' ' 401' ' ' ILE . 32.0 m -122.52 147.37 26.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.413 0.625 . . . . 0.0 111.42 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.624 ' CB ' HG22 ' B' ' 401' ' ' ILE . 9.3 tmtt? 80.55 55.97 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.961 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.444 ' C ' ' O ' ' B' ' 391' ' ' LYS . 2.8 mmtt -34.55 142.69 0.23 Allowed Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.672 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.442 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 14.6 Cg_exo -65.67 162.95 32.18 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.214 1.943 . . . . 0.0 111.845 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 22.8 p -132.29 158.99 40.43 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.855 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -82.01 7.66 12.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.517 179.011 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 396' ' ' VAL . . . . . 0.767 HG23 ' OD2' ' B' ' 397' ' ' ASP . 20.5 m -128.67 -15.72 2.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.313 178.357 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.767 ' OD2' HG23 ' B' ' 396' ' ' VAL . 1.3 m-20 -158.83 65.41 2.88 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.543 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.442 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 74.7 Cg_exo -40.86 -40.31 3.56 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 123.607 2.871 . . . . 0.0 114.092 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.522 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 3.0 p-10 -33.74 140.7 0.05 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.049 0.452 . . . . 0.0 111.502 -178.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 2.7 m -143.23 163.0 34.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.466 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.987 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -123.74 140.92 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 121.211 0.529 . . . . 0.0 111.557 -179.273 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.851 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -102.84 179.3 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.121 179.479 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.66 ' CB ' HG23 ' B' ' 388' ' ' VAL . 0.1 OUTLIER -149.97 108.38 3.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.024 0.44 . . . . 0.0 110.531 178.902 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.903 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 1.8 t -82.55 116.88 22.17 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.598 ' HA ' ' O ' ' B' ' 410' ' ' THR . 2.5 ptm180 -152.16 172.32 16.54 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.416 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.82 HG12 ' HG ' ' B' ' 385' ' ' LEU . 3.7 m -139.86 138.37 38.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.895 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 407' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' B' ' 384' ' ' ARG . . . -35.66 -36.83 0.12 Allowed Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 116.105 -0.498 . . . . 0.0 113.326 -179.26 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -55.55 -17.51 5.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.046 0.45 . . . . 0.0 110.382 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 95.66 45.81 2.85 Favored Glycine 0 N--CA 1.445 -0.718 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.625 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.699 ' HB ' HG22 ' B' ' 406' ' ' VAL . 37.4 m -131.55 112.59 12.76 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 -179.138 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' B' ' 404' ' ' CYS . 30.4 t -84.43 86.64 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.416 179.006 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.762 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.0 OUTLIER -46.36 -23.1 0.31 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.98 -179.528 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.27 -154.51 25.4 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.042 -1.075 . . . . 0.0 113.383 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.676 HG22 HD11 ' B' ' 401' ' ' ILE . 3.3 m -155.99 154.64 31.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.73 -0.235 . . . . 0.0 110.472 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.648 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -139.94 160.81 26.28 Favored Glycine 0 C--O 1.224 -0.523 0 C-N-CA 119.691 -1.242 . . . . 0.0 113.981 -179.48 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.402 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 1.4 p -146.52 145.57 19.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.694 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -161.69 132.71 2.92 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.061 -1.066 . . . . 0.0 113.246 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.518 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 6.6 ttm180 -54.33 -53.58 51.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.948 0.404 . . . . 0.0 110.896 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.849 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -79.48 -15.88 57.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.136 179.343 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.849 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 93.23 -42.69 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.159 0 C-N-CA 123.434 0.693 . . . . 0.0 111.536 -179.514 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.577 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.1 OUTLIER -52.63 -45.89 66.82 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.01 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.778 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -52.95 -36.58 24.17 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.691 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 177.648 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.851 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -66.75 -43.4 84.23 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.556 178.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.87 -64.95 3.3 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.258 -0.972 . . . . 0.0 111.144 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.548 ' O ' ' HB3' ' B' ' 428' ' ' ALA . 53.6 mt -52.97 -41.54 41.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.852 0.358 . . . . 0.0 110.471 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.598 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 6.4 tpt180 -57.66 -55.86 29.37 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.495 ' HA ' ' OD1' ' B' ' 430' ' ' ASN . . . -40.81 -44.88 2.34 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 1.006 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -53.04 -62.96 1.31 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.648 178.512 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.467 ' HA ' HD11 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -48.29 -31.83 6.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.35 179.117 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.495 ' OD1' ' HA ' ' B' ' 427' ' ' ALA . 9.1 m120 -67.56 -31.69 71.93 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.785 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.903 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -70.96 -48.26 54.38 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.763 0.316 . . . . 0.0 110.643 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.928 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -89.94 14.38 12.31 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.756 179.486 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.53 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 8.6 ttt-85 -86.08 3.28 43.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.426 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.513 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 3.7 t70 -126.5 92.39 3.55 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.115 0.484 . . . . 0.0 111.011 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.536 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -55.86 -32.88 64.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.668 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.536 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 15.6 mtmm -66.92 -59.22 3.7 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.518 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.762 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.9 OUTLIER -55.53 -51.78 65.89 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.286 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.928 HD11 ' HA ' ' B' ' 432' ' ' LEU . 96.0 mt -53.58 -65.65 0.53 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 178.726 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -42.09 -37.56 1.44 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.366 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.533 ' C ' ' CD1' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -63.81 -42.77 97.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.633 179.439 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.559 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 50.4 m-85 -71.91 -35.8 69.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.262 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.72 -48.37 63.62 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -38.59 90.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.628 178.479 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.559 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -64.96 -23.16 67.14 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.233 179.516 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.525 ' CZ ' ' HB3' ' B' ' 380' ' ' TYR . 13.7 tpt180 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.143 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.524 ' HA ' HG23 ' B' ' 425' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.236 0.361 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.487 ' HA ' ' HD2' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -29.94 -65.06 0.11 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.947 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 369' ' ' ASN . . . . . 0.453 ' CG ' ' CE ' ' B' ' 368' ' ' MET . 2.9 m120 -42.27 -49.22 5.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.798 0.332 . . . . 0.0 110.486 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.822 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -58.95 -79.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.42 179.737 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.487 ' HD2' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -36.22 -40.97 0.24 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.086 0.47 . . . . 0.0 110.17 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.539 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.2 tmm_? -59.4 -63.52 1.27 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.278 179.221 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.62 ' HB3' HD22 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -45.56 -34.98 3.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.394 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.758 HD11 ' HA ' ' B' ' 428' ' ' ALA . 1.3 mt -68.44 -76.73 0.09 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 375' ' ' TYR . . . . . 0.523 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.9 m-30 -84.91 21.58 1.56 Allowed 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.118 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -131.02 -36.7 1.32 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.731 0.3 . . . . 0.0 111.04 179.706 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.653 ' O ' HD13 ' B' ' 378' ' ' ILE . 2.1 mp -102.89 -27.55 12.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.161 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.653 HD13 ' O ' ' B' ' 377' ' ' LEU . 3.6 mm -139.91 37.43 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.134 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.444 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.523 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -126.52 93.36 0.4 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.351 -0.928 . . . . 0.0 112.909 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.475 ' CD2' ' HG2' ' B' ' 445' ' ' ARG . 42.8 p90 -105.43 -169.72 1.64 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.712 0.292 . . . . 0.0 110.291 179.335 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.613 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -87.19 109.41 19.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.26 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.613 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 10.7 t 104.1 37.26 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.755 0.66 . . . . 0.0 111.782 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.541 ' CD1' ' O ' ' B' ' 378' ' ' ILE . 2.8 tt -87.43 -49.43 7.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.11 0.481 . . . . 0.0 110.056 179.014 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.479 ' HB3' ' HA3' ' B' ' 407' ' ' GLY . 0.0 OUTLIER 72.08 35.7 1.24 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.406 178.758 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.633 HD12 HG12 ' B' ' 406' ' ' VAL . 0.3 OUTLIER -40.21 140.8 0.56 Allowed 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.617 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.556 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 1.4 t60 -128.24 83.31 2.15 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 -178.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.591 ' CE1' ' SG ' ' B' ' 404' ' ' CYS . 3.9 m-85 -83.84 116.98 23.0 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.104 177.275 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.82 113.78 44.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.9 0.381 . . . . 0.0 111.074 -179.823 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 54.3 m -77.37 127.92 33.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.348 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.773 HG23 HG23 ' B' ' 401' ' ' ILE . 31.8 m -134.6 151.54 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.097 0.475 . . . . 0.0 111.448 -179.531 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.503 ' HB3' ' O ' ' B' ' 390' ' ' VAL . 10.7 tppt? 83.31 54.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.952 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.444 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 0.0 OUTLIER -34.95 142.83 0.24 Allowed Pre-proline 0 C--N 1.332 -0.153 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.415 179.842 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.502 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 2.7 Cg_exo -74.3 155.54 46.36 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 122.34 2.027 . . . . 0.0 113.434 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.487 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 1.7 p -138.69 165.96 25.61 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.507 -1.224 . . . . 0.0 111.762 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -86.89 12.9 9.99 Favored 'General case' 0 CA--C 1.527 0.088 0 CA-C-O 121.33 0.586 . . . . 0.0 110.276 178.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 3.7 m -138.52 18.91 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.507 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.442 ' H ' ' CD ' ' B' ' 398' ' ' PRO . 0.8 OUTLIER 162.77 55.82 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.28 -179.538 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.502 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 3.9 Cg_endo -46.52 -48.79 13.0 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 123.623 2.882 . . . . 0.0 112.745 -179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.579 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.6 OUTLIER -32.57 130.28 0.18 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.028 -178.814 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 13.8 m -132.58 159.51 39.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.392 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.773 HG23 HG23 ' B' ' 390' ' ' VAL . 16.8 tt -117.32 164.79 13.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.962 0.41 . . . . 0.0 111.221 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.609 HG23 ' O ' ' B' ' 415' ' ' GLY . 0.2 OUTLIER -135.69 138.67 47.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.013 -179.001 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.494 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 6.5 mt-10 -101.35 126.15 48.07 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.591 ' SG ' ' CE1' ' B' ' 387' ' ' TYR . 19.0 t -109.03 102.35 11.34 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.883 ' HB3' HG22 ' B' ' 411' ' ' VAL . 17.9 ptt180 -143.45 111.47 6.12 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.352 0.596 . . . . 0.0 111.485 -178.695 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.826 HG13 HD21 ' B' ' 412' ' ' LEU . 10.2 m -59.05 150.3 5.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.597 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 407' ' ' GLY . . . . . 0.479 ' HA3' ' HB3' ' B' ' 384' ' ' ARG . . . -52.5 -15.72 3.13 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.003 -0.999 . . . . 0.0 113.908 -179.129 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.14 -2.92 14.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.794 0.33 . . . . 0.0 110.564 179.623 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 86.74 41.79 6.66 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.618 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.547 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 21.5 m -140.72 125.37 17.95 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.803 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.883 HG22 ' HB3' ' B' ' 405' ' ' ARG . 54.9 t -87.46 112.58 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.309 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.303 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.826 HD21 HG13 ' B' ' 406' ' ' VAL . 1.2 mm? -67.75 -41.02 84.03 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.205 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . -177.42 -149.05 7.61 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.573 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.494 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -151.08 173.94 13.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.733 0.301 . . . . 0.0 110.906 -179.803 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.609 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -162.09 122.65 1.12 Allowed Glycine 0 C--O 1.227 -0.327 0 C-N-CA 120.186 -1.007 . . . . 0.0 113.066 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.412 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 6.4 p -126.67 149.42 31.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.805 0.336 . . . . 0.0 110.606 179.536 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.932 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -163.5 158.08 30.42 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.024 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 418' ' ' ARG . . . . . . . . . . . . . 8.8 ptt180 -63.2 -42.26 99.28 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.16 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.859 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.9 OUTLIER -101.46 30.15 4.41 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 179.418 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.745 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.55 -43.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 115.37 1.618 . . . . 0.0 115.37 178.402 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.624 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -48.91 -47.29 43.49 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.711 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.932 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -49.45 -38.34 12.33 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.541 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.745 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -61.92 -48.32 80.98 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.627 178.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.478 ' HA2' HG21 ' B' ' 402' ' ' VAL . . . -63.33 -65.36 3.13 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.319 -0.943 . . . . 0.0 111.404 179.042 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.524 HG23 ' HA ' ' B' ' 367' ' ' ASP . 0.8 OUTLIER -50.37 -32.76 9.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.893 0.377 . . . . 0.0 109.994 178.925 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.593 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 27.6 tpt180 -65.46 -48.07 73.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.929 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.526 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -48.91 -42.1 35.83 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.822 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -58.07 -60.1 4.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.707 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.479 ' O ' ' HG ' ' B' ' 432' ' ' LEU . 14.6 mm-40 -48.73 -33.09 9.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.012 179.143 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.494 ' ND2' ' O ' ' B' ' 414' ' ' THR . 1.2 m-80 -65.02 -39.08 92.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.289 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.53 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -62.33 -41.75 98.81 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.156 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.686 HD23 HD21 ' B' ' 374' ' ' LEU . 0.3 OUTLIER -87.33 0.37 55.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.795 179.414 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' B' ' 433' ' ' ARG . 54.8 ttt-85 -88.28 16.45 6.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.977 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.438 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 9.6 m-20 -129.21 76.54 1.73 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.131 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.5 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -51.4 -32.54 26.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.097 0.475 . . . . 0.0 109.87 179.524 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.5 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -69.82 -42.37 73.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.092 179.642 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.489 ' HE2' HD12 ' B' ' 412' ' ' LEU . 13.2 tmm? -76.89 -44.73 30.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.027 179.243 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.634 HD11 ' HA ' ' B' ' 432' ' ' LEU . 68.1 mt -52.84 -67.69 0.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.057 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -53.36 -42.66 67.08 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.681 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.5 ' HB3' ' O ' ' B' ' 436' ' ' LYS . 2.5 t80 -53.7 -32.52 52.19 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.836 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.544 ' OH ' HG21 ' B' ' 406' ' ' VAL . 3.7 m-85 -78.7 -30.37 46.01 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.03 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -52.87 -39.52 62.69 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 177.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.15 -42.09 60.49 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.248 177.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.539 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -63.21 -13.8 41.73 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.406 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.475 ' HG2' ' CD2' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.191 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.665 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.547 ' N ' ' OD1' ' B' ' 367' ' ' ASP . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.329 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.501 ' N ' ' HE2' ' B' ' 371' ' ' LYS . 10.8 ptm -34.74 -43.14 0.17 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.407 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -64.08 -49.85 70.66 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.024 0.44 . . . . 0.0 109.83 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.657 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -53.73 -78.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.107 179.042 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.501 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -32.5 -50.69 0.25 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.091 -179.587 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.541 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -51.96 -45.42 64.4 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.413 179.766 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.546 ' HA ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -58.93 -52.08 67.27 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.366 0.603 . . . . 0.0 110.898 179.775 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.719 HD23 ' N ' ' B' ' 374' ' ' LEU . 1.5 mt -53.68 -73.85 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.429 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -82.65 -33.67 27.73 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.326 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.541 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -82.1 -16.38 50.18 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.111 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.546 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.4 OUTLIER -120.19 -24.77 5.87 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.357 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.679 HG22 ' CD1' ' B' ' 383' ' ' LEU . 27.7 mm -124.13 -65.83 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 C-N-CA 120.796 -0.362 . . . . 0.0 111.949 -179.218 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' B' ' 374' ' ' LEU . . . -56.29 79.06 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.459 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.696 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 2.5 p90 -60.55 -41.46 94.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.498 0.19 . . . . 0.0 111.169 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.696 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 154.99 -20.3 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.893 0.378 . . . . 0.0 111.169 179.685 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 1.7 m -127.29 39.62 3.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.69 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.679 ' CD1' HG22 ' B' ' 378' ' ' ILE . 0.5 OUTLIER -99.2 -36.3 9.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.068 -179.858 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 76.52 48.27 0.07 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.051 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.669 ' HA ' HG12 ' B' ' 406' ' ' VAL . 9.6 tt -89.39 143.11 27.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.56 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.406 ' NE2' ' HG3' ' B' ' 405' ' ' ARG . 14.3 p-80 -164.12 138.27 5.57 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.481 0.658 . . . . 0.0 112.576 -179.485 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.624 ' HE1' HD21 ' B' ' 385' ' ' LEU . 15.2 m-85 -98.48 142.14 30.46 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.077 178.707 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.786 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -122.29 116.72 49.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.896 -179.793 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 18.2 m -60.0 85.99 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 177.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.983 HG13 HG23 ' B' ' 401' ' ' ILE . 1.6 p -83.43 132.15 32.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.25 -0.887 . . . . 0.0 111.448 -177.316 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.537 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.9 OUTLIER 90.88 132.88 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.546 -178.348 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.488 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 1.5 mmmm -85.56 123.06 73.19 Favored Pre-proline 0 N--CA 1.464 0.244 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.343 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.488 ' HD3' ' HA ' ' B' ' 392' ' ' LYS . 2.9 Cg_exo -74.64 164.07 34.53 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.979 2.453 . . . . 0.0 113.357 -179.68 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.436 HG23 ' O ' ' B' ' 397' ' ' ASP . 0.6 OUTLIER -107.74 -158.74 0.66 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.342 179.769 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -89.13 -48.53 7.33 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.551 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 396' ' ' VAL . . . . . 0.515 ' C ' ' CD ' ' B' ' 398' ' ' PRO . 2.7 m -111.74 -13.1 11.38 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-O 121.658 0.742 . . . . 0.0 110.266 179.161 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.564 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 0.8 OUTLIER -115.44 44.95 0.39 Allowed Pre-proline 0 C--N 1.318 -0.776 0 CA-C-N 114.53 -1.213 . . . . 0.0 110.966 179.888 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' B' ' 397' ' ' ASP . 13.7 Cg_exo -45.67 -22.21 1.09 Allowed 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.533 2.156 . . . . 0.0 112.062 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' B' ' 398' ' ' PRO . 0.7 OUTLIER -20.26 88.64 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.295 0 O-C-N 123.665 0.603 . . . . 0.0 111.233 179.997 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 400' ' ' SER . . . . . 0.479 ' N ' ' O ' ' B' ' 398' ' ' PRO . 18.0 t -119.21 159.87 23.23 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.283 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.983 HG23 HG13 ' B' ' 390' ' ' VAL . 13.6 tt -112.26 160.61 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-O 121.476 0.655 . . . . 0.0 111.003 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.789 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.4 OUTLIER -120.25 142.04 37.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.786 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.786 ' CB ' HG23 ' B' ' 388' ' ' VAL . 0.3 OUTLIER -106.11 121.33 43.94 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.461 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.565 ' O ' ' N ' ' B' ' 412' ' ' LEU . 2.6 m -101.76 105.93 16.87 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.49 ' HA ' ' O ' ' B' ' 410' ' ' THR . 1.6 ptm180 -138.01 -179.94 6.07 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.364 0.602 . . . . 0.0 112.357 -178.036 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.684 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -148.63 139.75 17.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.02 -179.431 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 407' ' ' GLY . . . . . 0.465 ' O ' ' CG ' ' B' ' 408' ' ' ASP . . . 56.29 16.29 14.06 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.15 -1.024 . . . . 0.0 110.737 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 408' ' ' ASP . . . . . 0.47 ' O ' ' OD1' ' B' ' 408' ' ' ASP . 1.9 p30 55.29 32.98 19.74 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.226 0.536 . . . . 0.0 110.336 -179.259 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -140.26 -26.64 0.23 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.517 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.684 ' HB ' HG23 ' B' ' 406' ' ' VAL . 44.6 m -121.24 110.92 16.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 117.143 0.471 . . . . 0.0 112.226 -179.234 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.484 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 60.1 t -86.53 111.63 21.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.336 178.644 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.815 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.3 OUTLIER -66.85 -37.74 85.03 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.248 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . -178.67 -143.44 5.25 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.452 -0.88 . . . . 0.0 112.408 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.792 ' OG1' HD11 ' B' ' 401' ' ' ILE . 11.5 t -176.1 170.1 2.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.557 0.218 . . . . 0.0 110.886 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.489 ' O ' HG13 ' B' ' 401' ' ' ILE . . . -161.18 146.43 12.29 Favored Glycine 0 C--O 1.226 -0.398 0 C-N-CA 120.348 -0.929 . . . . 0.0 112.804 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.845 HG22 ' HB ' ' B' ' 401' ' ' ILE . 54.7 t -121.34 155.05 25.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.813 0.339 . . . . 0.0 110.704 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.903 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -165.05 141.32 6.97 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.128 -1.034 . . . . 0.0 113.117 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.474 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -63.62 -41.54 98.27 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.722 0.296 . . . . 0.0 111.047 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.839 ' H ' HD11 ' B' ' 422' ' ' ILE . 8.6 p30 -102.47 29.68 5.09 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.509 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.684 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 47.81 -44.42 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 178.629 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.604 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -48.37 -48.95 36.31 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 119.116 0.871 . . . . 0.0 108.676 -179.398 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.903 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.52 -38.21 5.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.533 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.789 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -66.29 -43.2 86.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.493 178.163 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.48 -67.25 2.14 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.774 -0.727 . . . . 0.0 111.978 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.441 HG12 ' HG2' ' B' ' 421' ' ' LYS . 5.0 mm -50.25 -59.38 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.825 0.345 . . . . 0.0 111.205 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.586 ' HG3' ' N ' ' B' ' 427' ' ' ALA . 0.0 OUTLIER -49.36 -44.47 44.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.21 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.586 ' N ' ' HG3' ' B' ' 426' ' ' ARG . . . -47.4 -51.67 19.11 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.657 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -52.22 -50.9 61.04 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.828 179.15 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.496 ' HA ' ' CG ' ' B' ' 432' ' ' LEU . 40.2 mt-10 -56.22 -34.16 66.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.882 179.023 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.4 OUTLIER -59.91 -41.06 90.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.461 179.344 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.435 ' HB2' ' OH ' ' B' ' 387' ' ' TYR . . . -64.13 -42.55 96.77 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.234 0.54 . . . . 0.0 110.295 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.705 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.3 OUTLIER -84.26 7.03 20.54 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.482 179.328 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 10.0 mtt180 -94.86 14.3 21.95 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.084 0.468 . . . . 0.0 110.969 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.554 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 67.4 m-20 -125.73 78.27 1.73 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.821 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.553 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 8.6 ptpt -46.85 -53.55 11.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.047 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.553 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.3 mttt -55.65 -40.54 72.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 0.0 110.695 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.815 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.1 OUTLIER -71.91 -46.7 56.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.317 179.546 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.705 HD11 ' HA ' ' B' ' 432' ' ' LEU . 72.2 mt -57.95 -61.69 2.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.002 179.292 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -54.27 -33.23 58.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.906 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' B' ' 437' ' ' MET . 5.8 t80 -59.21 -38.57 80.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.493 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.625 ' CE1' HD21 ' B' ' 383' ' ' LEU . 53.2 m-85 -79.42 -27.2 41.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.112 179.029 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -59.66 -52.48 65.35 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.23 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.9 -47.17 86.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 177.811 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.486 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.7 OUTLIER -59.82 -17.01 32.76 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.15 178.591 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.196 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.343 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.663 ' O ' ' HB3' ' B' ' 370' ' ' ALA . 3.4 p30 . . . . . 0 C--O 1.236 0.364 0 CA-C-O 120.919 0.39 . . . . 0.0 110.965 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.542 ' HE3' ' N ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -54.37 -55.16 31.34 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.824 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 369' ' ' ASN . . . . . 0.542 ' N ' ' HE3' ' B' ' 368' ' ' MET . 16.1 m120 -55.18 -37.74 67.44 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.318 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.663 ' HB3' ' O ' ' B' ' 367' ' ' ASP . . . -49.87 -78.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.746 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -41.68 -42.16 2.45 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.33 0.586 . . . . 0.0 109.939 179.606 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.557 ' O ' ' CB ' ' B' ' 376' ' ' SER . 13.7 ttp180 -55.64 -46.82 77.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.484 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.563 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.8 OUTLIER -57.29 -47.07 82.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.437 0.637 . . . . 0.0 110.49 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.755 HD23 ' N ' ' B' ' 374' ' ' LEU . 1.3 mt -51.63 -70.57 0.08 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.58 -179.029 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 375' ' ' TYR . . . . . 0.449 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.3 m-85 -84.97 -42.08 15.27 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -177.642 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.9 OUTLIER -65.41 -29.3 69.98 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.835 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.563 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 4.3 mm? -110.94 -44.58 3.59 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.886 -179.423 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.549 HG13 ' CD2' ' B' ' 438' ' ' LEU . 0.9 OUTLIER -118.45 51.59 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.983 0.421 . . . . 0.0 111.432 -179.185 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.449 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -140.22 44.6 1.05 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.219 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.697 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 23.5 p90 -91.03 -45.93 8.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.678 0.275 . . . . 0.0 111.169 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.697 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 160.85 -168.0 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.266 0.555 . . . . 0.0 111.638 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 5.7 t 43.91 22.27 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.562 -0.745 . . . . 0.0 112.083 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.769 ' CD1' HD12 ' B' ' 385' ' ' LEU . 2.0 pt? -127.39 -0.49 6.3 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.485 ' HB2' ' HA2' ' B' ' 407' ' ' GLY . 1.3 mmt180 29.95 49.48 0.06 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.344 179.197 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.769 HD12 ' CD1' ' B' ' 383' ' ' LEU . 0.4 OUTLIER -59.94 129.76 43.39 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 121.073 0.464 . . . . 0.0 111.411 -179.505 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.581 ' CD2' ' O ' ' B' ' 386' ' ' HIS . 24.0 p-80 -167.79 108.88 0.59 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.154 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.511 ' HA ' ' HA ' ' B' ' 404' ' ' CYS . 2.8 m-85 -55.76 175.55 0.08 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.149 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.42 ' N ' ' O ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -157.54 101.87 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.743 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 31.4 m -77.18 106.32 8.83 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.661 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.723 HG23 HG23 ' B' ' 401' ' ' ILE . 28.4 m -112.42 150.43 14.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 0.0 110.678 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.654 ' HB3' HG22 ' B' ' 401' ' ' ILE . 8.2 tppt? 72.44 48.97 0.22 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.38 -179.395 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' B' ' 391' ' ' LYS . 2.2 mtmt -33.79 143.64 0.18 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.194 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.468 ' O ' HG22 ' B' ' 394' ' ' THR . 32.3 Cg_exo -58.23 179.98 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.954 2.436 . . . . 0.0 112.499 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.532 ' OG1' ' N ' ' B' ' 397' ' ' ASP . 0.1 OUTLIER -160.84 155.42 23.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.089 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -59.24 -23.27 62.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.138 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 2.8 m -123.96 13.44 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.234 0.54 . . . . 0.0 110.264 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.541 ' N ' ' HD3' ' B' ' 398' ' ' PRO . 0.8 OUTLIER -157.51 51.96 0.53 Allowed Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.468 179.645 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.541 ' HD3' ' N ' ' B' ' 397' ' ' ASP . 85.4 Cg_exo -46.65 -29.02 7.14 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.788 2.325 . . . . 0.0 112.396 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.498 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 20.8 p-10 -53.27 132.0 38.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.258 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -135.37 144.33 46.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.123 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 1.03 HD12 ' O ' ' B' ' 415' ' ' GLY . 0.6 OUTLIER -107.29 100.17 10.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-O 121.213 0.53 . . . . 0.0 111.223 -179.463 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.819 HG23 ' HB1' ' B' ' 423' ' ' ALA . 0.4 OUTLIER -72.39 163.2 4.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.048 179.716 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.513 ' HG2' ' N ' ' B' ' 404' ' ' CYS . 44.9 tt0 -148.9 158.49 44.21 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.79 ' O ' ' O ' ' B' ' 411' ' ' VAL . 24.3 t -132.49 130.72 40.83 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 178.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -129.79 126.99 39.43 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 123.697 0.623 . . . . 0.0 110.776 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.718 ' CG2' HD22 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -124.64 134.23 67.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.516 -179.287 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 407' ' ' GLY . . . . . 0.485 ' HA2' ' HB2' ' B' ' 384' ' ' ARG . . . 64.18 5.78 17.06 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.754 -0.736 . . . . 0.0 111.866 -179.273 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 66.48 68.61 0.43 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 163.87 -46.51 0.31 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.113 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.589 ' HB ' HG23 ' B' ' 406' ' ' VAL . 12.0 m -86.78 113.47 22.64 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.79 ' O ' ' O ' ' B' ' 404' ' ' CYS . 3.9 t -76.6 -60.93 1.91 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 -177.026 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.735 ' HG ' ' HE2' ' B' ' 437' ' ' MET . 0.1 OUTLIER 63.9 -39.2 0.21 Allowed 'General case' 0 C--N 1.315 -0.893 0 O-C-N 120.144 -1.598 . . . . 0.0 111.569 -178.51 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.587 ' HA2' ' HB3' ' B' ' 430' ' ' ASN . . . -112.97 127.5 7.97 Favored Glycine 0 C--N 1.35 1.326 0 C-N-CA 119.511 -1.328 . . . . 0.0 113.774 -179.54 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.523 ' N ' ' OD1' ' B' ' 430' ' ' ASN . 0.2 OUTLIER -165.84 63.16 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.709 0.29 . . . . 0.0 111.295 179.431 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 1.03 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -109.82 172.81 16.18 Favored Glycine 0 C--O 1.226 -0.368 0 C-N-CA 120.407 -0.901 . . . . 0.0 113.667 -178.411 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.463 HG22 ' H ' ' B' ' 417' ' ' GLY . 5.7 p -131.96 166.76 28.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.583 0.23 . . . . 0.0 110.628 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.75 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -172.81 116.25 0.6 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.092 -1.052 . . . . 0.0 113.184 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.489 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -43.69 -68.2 0.22 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.713 0.292 . . . . 0.0 110.386 179.324 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.893 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.2 OUTLIER -66.6 -20.57 66.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.039 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.893 HG23 ' O ' ' B' ' 419' ' ' ASN . 1.1 pp 102.29 -39.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 124.387 1.075 . . . . 0.0 111.37 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -49.63 -52.04 33.49 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.75 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.75 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.49 -33.27 2.96 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.519 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 177.417 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.819 ' HB1' HG23 ' B' ' 402' ' ' VAL . . . -74.22 -34.44 63.69 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.478 179.508 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -70.58 -56.24 7.71 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.149 -1.024 . . . . 0.0 111.152 178.613 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.574 ' O ' ' HB3' ' B' ' 428' ' ' ALA . 3.5 mp -63.77 -42.93 97.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.729 0.299 . . . . 0.0 110.446 179.168 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.576 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 17.8 tpt180 -53.51 -53.01 57.59 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.596 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -51.57 -40.23 59.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.574 ' HB3' ' O ' ' B' ' 425' ' ' ILE . . . -52.49 -74.21 0.04 OUTLIER 'General case' 0 C--O 1.236 0.393 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.508 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.551 ' HA ' ' HG ' ' B' ' 432' ' ' LEU . 3.3 mt-10 -43.04 -36.28 1.55 Allowed 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.587 ' HB3' ' HA2' ' B' ' 413' ' ' GLY . 0.3 OUTLIER -53.2 -36.86 61.42 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.263 178.954 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.568 ' O ' ' HE1' ' B' ' 437' ' ' MET . . . -83.51 -18.96 36.67 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 120.911 0.386 . . . . 0.0 110.782 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.596 HD22 ' HA ' ' B' ' 370' ' ' ALA . 0.8 OUTLIER -115.81 21.58 13.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.177 0.513 . . . . 0.0 109.965 178.938 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' B' ' 429' ' ' GLU . 38.0 mtt-85 -109.63 3.15 20.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.043 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.454 ' OD2' ' HA ' ' B' ' 412' ' ' LEU . 43.8 m-20 -106.37 77.07 1.18 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.303 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.539 ' HG3' ' N ' ' B' ' 436' ' ' LYS . 5.5 ptpp? -38.89 -48.08 1.51 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.558 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.539 ' N ' ' HG3' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -57.57 -51.56 68.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.043 -179.716 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.735 ' HE2' ' HG ' ' B' ' 412' ' ' LEU . 15.4 tmm? -61.43 -56.59 18.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.146 0.498 . . . . 0.0 110.0 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.549 ' CD2' HG13 ' B' ' 378' ' ' ILE . 60.4 mt -47.81 -64.77 0.7 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.882 178.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -54.92 -25.22 27.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.465 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.474 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -69.83 -39.08 76.67 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.362 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.555 ' HA ' ' HB2' ' B' ' 444' ' ' GLN . 32.4 m-85 -76.01 -51.97 11.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.174 179.118 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' B' ' 445' ' ' ARG . . . -44.45 -46.31 9.56 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -40.06 91.59 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.519 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.555 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -68.64 -7.18 30.77 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.49 178.917 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.589 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.411 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.621 ' O ' ' HB3' ' B' ' 370' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.162 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.575 ' CE ' ' HB3' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -48.14 -48.95 33.86 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.981 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 369' ' ' ASN . . . . . 0.575 ' HB3' ' CE ' ' B' ' 368' ' ' MET . 0.5 OUTLIER -66.12 -25.72 67.12 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 178.786 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' B' ' 367' ' ' ASP . . . -58.99 -70.7 0.14 Allowed 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.47 ' HD2' ' O ' ' B' ' 367' ' ' ASP . 0.1 OUTLIER -48.74 -33.27 9.91 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.317 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.548 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -58.88 -46.64 87.33 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.867 -1.061 . . . . 0.0 109.959 178.839 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.548 ' OE1' HD22 ' B' ' 438' ' ' LEU . 0.1 OUTLIER -63.02 -45.54 91.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.497 -179.785 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.836 HD22 ' HB3' ' B' ' 431' ' ' ALA . 0.4 OUTLIER -57.55 -69.52 0.16 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -178.118 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -83.93 -33.97 24.57 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -177.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.8 ' C ' HD22 ' B' ' 377' ' ' LEU . 0.2 OUTLIER -81.97 -21.25 37.26 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.601 -0.44 . . . . 0.0 112.152 -178.932 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.822 ' O ' HD13 ' B' ' 378' ' ' ILE . 2.3 mm? -123.83 -6.59 7.93 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.603 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.822 HD13 ' O ' ' B' ' 377' ' ' LEU . 9.3 mm -145.6 -117.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 119.341 -0.361 . . . . 0.0 111.411 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.527 ' C ' ' O ' ' B' ' 378' ' ' ILE . . . -0.68 68.28 0.0 OUTLIER Glycine 0 C--N 1.346 1.096 0 N-CA-C 114.393 0.517 . . . . 0.0 114.393 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.596 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 0.1 OUTLIER -82.58 -78.07 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.02 0.438 . . . . 0.0 111.494 -179.764 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.596 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 164.36 50.28 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.091 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -147.34 6.55 0.86 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.623 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.66 ' H ' HD13 ' B' ' 383' ' ' LEU . 0.0 OUTLIER -152.42 18.51 0.63 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.179 0.514 . . . . 0.0 110.77 179.834 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 32.77 73.56 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.671 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.882 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.2 OUTLIER -59.52 114.17 2.57 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 177.791 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -122.2 102.46 8.15 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -176.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.778 ' OH ' ' HB2' ' B' ' 431' ' ' ALA . 13.2 m-85 -76.43 165.37 24.92 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 175.604 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.84 HG23 ' O ' ' B' ' 403' ' ' GLU . 0.2 OUTLIER -148.52 167.95 3.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 C-N-CA 120.131 -0.628 . . . . 0.0 111.003 178.95 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 7.7 m -130.54 118.12 20.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.92 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.926 HG23 HG23 ' B' ' 401' ' ' ILE . 20.3 m -130.03 153.4 38.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.799 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.504 ' HB3' HG22 ' B' ' 401' ' ' ILE . 0.1 OUTLIER 65.61 61.24 0.69 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.22 -179.779 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.19 139.19 56.08 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.472 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.577 ' HA ' ' HA ' ' B' ' 398' ' ' PRO . 11.0 Cg_endo -56.25 -172.89 0.04 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.574 2.183 . . . . 0.0 112.311 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.564 ' O ' ' HB2' ' B' ' 395' ' ' ALA . 54.9 p -157.02 -81.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.298 -0.41 . . . . 0.0 112.071 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 395' ' ' ALA . . . . . 0.564 ' HB2' ' O ' ' B' ' 394' ' ' THR . . . 167.76 -25.3 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 -179.549 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -116.22 -2.51 10.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.556 0.693 . . . . 0.0 110.16 178.877 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.438 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 1.3 m-20 179.06 56.39 0.06 OUTLIER Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.638 179.604 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.577 ' HA ' ' HA ' ' B' ' 393' ' ' PRO . 10.4 Cg_endo -54.57 -77.31 0.02 OUTLIER 'Trans proline' 0 CA--C 1.519 -0.251 0 C-N-CA 123.252 2.635 . . . . 0.0 112.884 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.55 ' O ' ' O ' ' B' ' 398' ' ' PRO . 0.4 OUTLIER 44.84 115.43 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.142 -179.542 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 400' ' ' SER . . . . . 0.477 ' HB3' ' HA ' ' B' ' 420' ' ' ILE . 2.0 t -113.21 117.33 31.58 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.733 179.527 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.926 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -108.04 106.61 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 CA-C-O 121.305 0.574 . . . . 0.0 110.663 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.807 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.3 OUTLIER -77.96 158.58 4.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.099 179.756 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.84 ' O ' HG23 ' B' ' 388' ' ' VAL . 7.2 tp10 -128.78 89.48 2.89 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.191 178.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.728 ' O ' ' O ' ' B' ' 411' ' ' VAL . 0.4 OUTLIER -82.42 114.83 21.13 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 178.076 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.528 ' HA ' ' O ' ' B' ' 411' ' ' VAL . 17.5 ptt85 -155.8 169.42 24.42 Favored 'General case' 0 C--O 1.226 -0.154 0 O-C-N 124.224 0.952 . . . . 0.0 109.744 -178.748 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 1.051 HG13 HD21 ' B' ' 412' ' ' LEU . 23.7 m -127.27 126.43 67.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.829 0.347 . . . . 0.0 111.772 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -35.05 -33.9 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 CA-C-N 115.709 -0.678 . . . . 0.0 113.314 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 408' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' B' ' 406' ' ' VAL . 15.1 t0 -59.47 -29.19 67.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.975 0.417 . . . . 0.0 110.675 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 118.03 47.26 0.44 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 121.038 -0.601 . . . . 0.0 111.769 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.625 ' HB ' HG22 ' B' ' 406' ' ' VAL . 0.2 OUTLIER -142.45 112.68 7.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.727 0.298 . . . . 0.0 111.402 -179.241 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.728 ' O ' ' O ' ' B' ' 404' ' ' CYS . 20.8 t -59.17 -63.7 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 1.051 HD21 HG13 ' B' ' 406' ' ' VAL . 0.0 OUTLIER 86.09 -42.55 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 O-C-N 121.485 -0.759 . . . . 0.0 109.31 -178.336 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.518 ' O ' ' CB ' ' B' ' 404' ' ' CYS . . . 167.46 175.15 37.15 Favored Glycine 0 C--N 1.339 0.736 0 C-N-CA 119.61 -1.281 . . . . 0.0 113.742 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.49 ' OG1' ' N ' ' B' ' 415' ' ' GLY . 0.0 OUTLIER -142.63 -177.64 5.39 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.481 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.784 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -158.07 117.34 0.77 Allowed Glycine 0 C--O 1.223 -0.555 0 C-N-CA 118.742 -1.694 . . . . 0.0 114.273 -179.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.462 ' HA ' ' O ' ' B' ' 400' ' ' SER . 38.3 t -107.45 145.07 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 178.34 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.595 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -166.91 145.94 10.36 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 119.531 -1.319 . . . . 0.0 113.467 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 418' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -53.31 36.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 110.653 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.901 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.5 OUTLIER -79.73 -21.83 44.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.24 179.512 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.901 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.8 OUTLIER 99.07 -41.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 C-N-CA 124.038 0.935 . . . . 0.0 111.429 -179.215 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.592 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -50.32 -42.2 52.39 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.436 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.63 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -56.72 -37.23 51.97 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.656 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 177.717 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.807 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -71.42 -31.55 67.37 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.145 179.061 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -71.39 -67.14 1.95 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.199 -1.001 . . . . 0.0 111.168 178.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.587 HD13 ' HG2' ' B' ' 421' ' ' LYS . 2.9 mp -51.66 -46.65 38.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 121.068 0.461 . . . . 0.0 110.207 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.566 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.4 tpt180 -54.25 -43.56 71.03 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.217 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.47 ' HB1' ' HE2' ' B' ' 387' ' ' TYR . . . -52.62 -49.99 63.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.175 179.402 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' B' ' 431' ' ' ALA . . . -54.75 -72.2 0.07 Allowed 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.22 0.533 . . . . 0.0 110.11 179.253 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.522 ' HG3' ' HB2' ' B' ' 370' ' ' ALA . 2.8 mt-10 -45.31 -28.02 0.76 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.936 179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.53 ' ND2' ' HG3' ' B' ' 426' ' ' ARG . 0.6 OUTLIER -68.02 -34.12 75.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.333 179.4 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.836 ' HB3' HD22 ' B' ' 374' ' ' LEU . . . -65.24 -47.46 76.7 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.308 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.834 ' CA ' HD11 ' B' ' 438' ' ' LEU . 0.7 OUTLIER -88.28 20.23 3.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.565 179.667 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 8.4 ttt-85 -90.02 1.02 56.78 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.039 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.541 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 95.2 m-20 -114.69 76.09 0.97 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.67 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.449 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -39.33 -45.38 1.43 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 -179.716 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.449 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.2 mmpt? -63.36 -53.48 51.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.922 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.573 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -60.14 -37.36 79.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.122 0.487 . . . . 0.0 109.97 179.501 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.834 HD11 ' CA ' ' B' ' 432' ' ' LEU . 58.6 mt -66.53 -55.62 14.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.213 179.694 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -64.62 -25.9 68.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.821 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.517 ' CE2' ' CE1' ' B' ' 441' ' ' TYR . 0.2 OUTLIER -69.4 -41.47 76.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.17 0.51 . . . . 0.0 109.663 179.34 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.542 ' CD1' ' OH ' ' B' ' 380' ' ' TYR . 16.0 m-85 -71.99 -39.87 68.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.707 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -54.79 -40.05 69.06 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 443' ' ' LYS . . . . . 0.453 ' O ' ' HE3' ' B' ' 443' ' ' LYS . 0.1 OUTLIER -69.94 -53.91 15.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.501 179.067 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.526 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -53.55 -30.38 41.55 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.182 0.515 . . . . 0.0 110.004 179.653 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.57 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.681 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.446 " O5'" ' H8 ' ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.694 0 C5'-C4'-C3' 111.036 -2.976 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.872 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.179 0 O4'-C1'-N19 111.181 2.981 . 0.189 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.872 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.174 0 O4'-C1'-N19 111.084 2.884 . 0.241 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.553 " H5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.19 0 O4'-C1'-N19 111.317 3.117 . 0.259 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.616 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.928 0 O4'-C1'-N19 111.302 3.102 . 0.381 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.506 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.212 0 O4'-C1'-N19 111.251 3.051 . 0.096 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.861 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.847 0 C5'-C4'-C3' 111.013 -2.991 . 0.169 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.682 ' N4 ' ' N4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.235 0 O4'-C1'-N19 111.27 3.07 . 0.299 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.528 ' N6 ' ' O6 ' ' A' ' 25' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.299 0 O4'-C1'-N19 111.303 3.103 . 0.249 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.653 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.951 0 C5'-C4'-C3' 111.02 -2.987 . 0.113 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.635 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.331 0 O4'-C1'-N19 111.111 2.911 . 0.039 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.782 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.065 0 O4'-C1'-N19 111.268 3.068 . 0.084 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.782 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.155 0 O4'-C1'-N19 111.383 3.183 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.722 " H5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.429 -2.023 0 C5'-C4'-C3' 111.079 -2.948 . 0.059 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.536 ' C5 ' ' N4 ' ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.161 0 C5'-C4'-C3' 110.884 -3.077 . 0.129 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.582 " O4'" ' N6 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.711 0 O4'-C1'-N19 111.255 3.055 . 0.01 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.765 " O2'" ' P ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.888 0 O4'-C1'-N19 111.605 3.405 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.765 ' P ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 P--O5' 1.614 2.097 0 O4'-C1'-N19 111.183 2.983 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.466 " O4'" " O2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.299 0 O4'-C1'-N19 111.229 3.029 . 0.143 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.625 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.876 0 O4'-C1'-N19 111.275 3.075 . 0.0 OUTLIER '7D dist &a' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.688 ' H8 ' " O5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.766 0 O4'-C1'-N19 111.39 3.19 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.771 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.069 0 O4'-C1'-N19 111.162 2.962 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.756 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.281 0 O4'-C1'-N19 111.74 3.54 . 0.017 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.756 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.293 0 C5'-C4'-C3' 111.412 -2.725 . 0.091 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.614 ' C2 ' ' C5 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.681 0 C3'-C2'-C1' 105.049 3.943 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.791 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.178 0 O4'-C1'-N19 111.024 2.824 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.825 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.17 0 O4'-C1'-N19 111.159 2.959 . 0.201 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.825 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.358 0 C3'-C2'-C1' 104.202 3.002 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.792 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.258 0 O4'-C1'-N19 111.157 2.957 . 0.254 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.792 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.242 0 O4'-C1'-N19 111.598 3.398 . 0.156 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.659 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.655 0 O4'-C1'-N19 111.337 3.137 . 0.165 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.559 0 C5'-C4'-C3' 111.152 -2.899 . 0.072 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.224 0 N-CA-C 112.46 -0.256 . . . . 0.0 112.46 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 42.54 47.55 4.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.765 0.317 . . . . 0.0 110.862 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.484 HD23 ' HE2' ' B' ' 368' ' ' MET . 7.2 tp -128.37 116.36 19.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.375 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.507 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.3 OUTLIER -55.74 -61.91 2.05 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.187 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.484 ' HE2' HD23 ' B' ' 366' ' ' LEU . 3.0 ttp -32.49 -52.21 0.29 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.507 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 32.0 m-20 -58.65 -49.79 76.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.224 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.61 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -54.86 -79.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.275 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.479 ' HD2' ' HB2' ' B' ' 367' ' ' ASP . 0.2 OUTLIER -29.33 -45.15 0.04 OUTLIER 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.031 0.443 . . . . 0.0 111.016 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.573 ' CD ' ' N3 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -61.64 -61.64 2.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.323 179.551 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.668 ' HB3' HD22 ' B' ' 432' ' ' LEU . 0.8 OUTLIER -40.93 -34.55 0.42 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.221 0.534 . . . . 0.0 110.137 179.309 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.648 ' N ' HD23 ' B' ' 374' ' ' LEU . 2.6 mt -68.29 -80.9 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.211 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.88 27.79 0.85 Allowed 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -178.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.525 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 1.1 p -135.92 -31.57 0.92 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.241 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.762 ' O ' HD13 ' B' ' 378' ' ' ILE . 1.1 mm? -109.39 -27.85 9.26 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.762 HD13 ' O ' ' B' ' 377' ' ' LEU . 19.0 mm -129.5 -62.5 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.804 -179.2 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.847 ' HA2' HD12 ' B' ' 383' ' ' LEU . . . -32.64 102.72 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.732 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.529 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 10.1 p90 -115.04 177.73 4.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.888 0.375 . . . . 0.0 110.831 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' B' ' 382' ' ' SER . . . -65.99 118.14 9.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.213 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.464 ' HB3' ' O ' ' B' ' 381' ' ' ALA . 8.4 t 79.13 45.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.224 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.847 HD12 ' HA2' ' B' ' 379' ' ' GLY . 0.1 OUTLIER -95.39 -42.16 8.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.809 0.338 . . . . 0.0 110.706 179.675 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.513 ' CB ' ' O ' ' B' ' 383' ' ' LEU . 3.8 tpm_? 84.56 -6.16 0.99 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.106 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.921 ' HA ' HG12 ' B' ' 406' ' ' VAL . 4.5 tt -36.02 129.5 0.66 Allowed 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.778 0.323 . . . . 0.0 110.583 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.445 ' N ' HD23 ' B' ' 385' ' ' LEU . 3.7 p80 -161.22 147.37 14.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.647 0.737 . . . . 0.0 112.862 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.494 ' OH ' ' HA ' ' B' ' 428' ' ' ALA . 11.9 m-85 -105.12 141.95 35.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.97 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -121.72 123.29 69.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.091 0.472 . . . . 0.0 111.289 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.15 130.41 38.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.629 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.669 HG23 ' CG2' ' B' ' 401' ' ' ILE . 28.0 m -141.36 144.9 25.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.964 0.411 . . . . 0.0 110.915 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.566 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 7.9 tptt 95.68 56.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.531 -179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.451 ' HA ' ' HD2' ' B' ' 393' ' ' PRO . 4.2 mmpt? -31.21 107.41 0.25 Allowed Pre-proline 0 N--CA 1.462 0.154 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.206 -179.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.489 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 4.3 Cg_exo -44.98 159.53 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.799 2.333 . . . . 0.0 113.353 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 16.6 p -128.12 158.27 38.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.972 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 395' ' ' ALA . . . . . 0.585 ' HB1' " H1'" ' A' ' 30' ' ' ' C' . . . -86.28 13.83 7.45 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.597 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 3.0 m -136.96 14.05 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.082 177.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.4 ' H ' ' HD3' ' B' ' 398' ' ' PRO . 0.4 OUTLIER 166.45 61.56 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 114.496 -1.229 . . . . 0.0 108.797 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.553 ' HB3' " C4'" ' A' ' 5' ' ' ' U' . 96.4 Cg_exo -42.8 -32.18 2.45 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.225 2.617 . . . . 0.0 113.086 -179.034 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.608 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.8 OUTLIER -30.67 127.21 0.15 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.022 -178.761 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 47.7 t -136.55 166.92 22.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.848 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.669 ' CG2' HG23 ' B' ' 390' ' ' VAL . 15.3 tt -122.51 161.98 22.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.105 0.478 . . . . 0.0 111.495 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.754 ' O ' HG22 ' B' ' 414' ' ' THR . 0.1 OUTLIER -128.68 143.76 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.943 -179.624 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 403' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -110.69 125.78 53.84 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.742 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 41.3 t -106.18 107.21 18.1 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.698 ' HB3' HG22 ' B' ' 411' ' ' VAL . 0.0 OUTLIER -147.65 -171.31 3.78 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.196 0.522 . . . . 0.0 111.536 -179.131 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.921 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.1 OUTLIER -135.85 147.5 28.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.157 -179.395 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 407' ' ' GLY . . . . . 0.456 ' HA3' ' HG2' ' B' ' 384' ' ' ARG . . . -35.34 -28.8 0.01 OUTLIER Glycine 0 C--N 1.332 0.311 0 CA-C-N 115.488 -0.778 . . . . 0.0 113.62 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 408' ' ' ASP . . . . . 0.463 ' N ' ' O ' ' B' ' 406' ' ' VAL . 59.3 m-20 -70.31 -3.17 15.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.877 0.37 . . . . 0.0 111.099 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 409' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 82.26 33.06 26.9 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.783 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.535 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 19.3 m -116.18 118.38 32.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.587 0.232 . . . . 0.0 111.375 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.698 HG22 ' HB3' ' B' ' 405' ' ' ARG . 70.9 t -92.32 111.9 25.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.156 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.535 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.5 OUTLIER -67.37 -36.21 80.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.364 -0.38 . . . . 0.0 109.978 179.164 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.45 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . -175.29 -152.57 9.45 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.518 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.754 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.1 OUTLIER -159.92 174.17 14.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.475 0.179 . . . . 0.0 110.701 -179.84 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.678 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -169.03 128.51 1.7 Allowed Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.133 -1.032 . . . . 0.0 112.877 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 7.1 p -123.49 155.59 29.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.853 0.358 . . . . 0.0 110.411 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.983 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -164.43 169.22 39.13 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.554 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 418' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -79.98 -39.95 29.0 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 117.312 0.556 . . . . 0.0 111.532 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.854 ' OD1' HD11 ' B' ' 422' ' ' ILE . 3.0 p-10 -101.99 31.75 3.77 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.763 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.79 -46.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.635 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -44.42 -55.17 5.23 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 118.796 0.725 . . . . 0.0 109.806 -179.474 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.983 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -42.83 -34.26 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.571 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.194 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.763 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -68.61 -44.81 73.48 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.184 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -60.03 -62.98 5.47 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.181 -1.009 . . . . 0.0 111.676 179.158 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.684 ' H ' HD12 ' B' ' 425' ' ' ILE . 4.4 mp -56.73 -42.24 76.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.91 0.386 . . . . 0.0 110.393 179.315 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.579 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -56.02 -43.57 77.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.126 179.434 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.591 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -56.41 -50.51 71.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.337 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.61 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -55.08 -59.65 4.46 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.665 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.468 ' O ' ' HB3' ' B' ' 433' ' ' ARG . 2.9 mt-10 -50.07 -29.87 9.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.124 0.488 . . . . 0.0 109.838 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.514 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 0.8 OUTLIER -67.79 -38.12 82.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.398 179.5 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.742 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -62.69 -41.79 99.29 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.165 0.507 . . . . 0.0 110.204 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.668 HD22 ' HB3' ' B' ' 373' ' ' GLN . 0.1 OUTLIER -87.26 5.94 35.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.362 179.124 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.514 ' CG ' ' O ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -89.4 11.81 18.14 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.109 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.569 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 14.4 m-20 -125.81 81.38 1.98 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.521 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 12.3 ptpt -46.93 -49.35 20.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.427 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.521 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.2 mmmm -61.22 -46.12 91.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.742 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.569 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 18.9 tmm? -63.24 -45.92 89.31 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.003 0.43 . . . . 0.0 110.076 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.459 HD11 ' HA ' ' B' ' 432' ' ' LEU . 84.3 mt -57.37 -62.42 1.78 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.915 179.231 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -54.03 -32.28 53.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.014 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.475 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.7 OUTLIER -57.86 -43.3 85.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.118 179.661 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 441' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -73.81 -28.31 61.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.568 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.57 -51.37 67.34 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 11.0 ttpp -63.31 -48.14 79.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.577 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.659 ' O ' HG23 ' B' ' 448' ' ' ILE . 3.6 mt-30 -50.11 -44.93 52.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.81 179.005 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.529 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -55.84 -47.07 77.9 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.361 179.506 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -61.96 -42.01 98.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.543 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.531 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -72.58 -78.0 0.09 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.963 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.659 HG23 ' O ' ' B' ' 444' ' ' GLN . 1.4 pt -0.39 103.9 0.02 OUTLIER Pre-proline 0 N--CA 1.467 0.389 0 O-C-N 124.066 0.854 . . . . 0.0 112.758 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 449' ' ' PRO . . . . . 0.528 ' CG ' ' OXT' ' B' ' 453' ' ' SER . 77.9 Cg_endo -83.83 71.62 5.72 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 123.036 2.491 . . . . 0.0 112.756 -179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 450' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' B' ' 449' ' ' PRO . 0.0 OUTLIER 50.94 30.56 5.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.625 179.683 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -176.57 -177.36 0.81 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.884 0.373 . . . . 0.0 111.085 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.13 -66.28 0.42 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.885 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 453' ' ' SER . . . . . 0.528 ' OXT' ' CG ' ' B' ' 449' ' ' PRO . 57.9 p . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.898 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.8 HO2' ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.735 0 O4'-C1'-N19 111.427 3.227 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.8 ' H8 ' HO2' ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.082 0 O4'-C1'-N19 111.093 2.893 . 0.116 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.476 ' C5 ' ' C6 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.41 0 C5'-C4'-C3' 111.17 -2.886 . 0.13 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.536 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.171 0 O4'-C1'-N19 111.238 3.038 . 0.124 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.65 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.147 0 O4'-C1'-N19 111.103 2.903 . 0.167 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.5 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.288 0 C5'-C4'-C3' 111.317 -2.789 . 0.326 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.69 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.003 0 O4'-C1'-N19 111.541 3.341 . 0.276 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.465 ' C6 ' " H2'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.312 0 O4'-C1'-N19 110.941 2.741 . 0.237 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.439 2.045 0 O4'-C1'-N19 111.111 2.911 . 0.454 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.5 " O2'" " C5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -2.024 0 C5'-C4'-C3' 111.071 -2.953 . 0.199 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.6 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.517 0 C5'-C4'-C3' 111.211 -2.859 . 0.024 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.659 " O2'" " C5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.432 -1.757 0 C5'-C4'-C3' 110.862 -3.092 . 0.074 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.668 " O2'" " C5'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.444 0 C3'-C2'-C1' 104.833 3.704 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.692 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.282 0 C5'-C4'-C3' 110.893 -3.071 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.692 " O4'" " H2'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.935 0 C5'-C4'-C3' 111.002 -2.999 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.815 " H4'" " O5'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -1.996 0 O4'-C1'-N19 111.306 3.106 OUTLIER-EPSILON 0.01 1b . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.815 " O5'" " H4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.432 -1.766 0 C5'-C4'-C3' 110.999 -3.0 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.761 " H2'" " O4'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 P--O5' 1.61 1.658 0 O4'-C1'-N19 110.982 2.782 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.761 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.097 0 C5'-C4'-C3' 111.162 -2.892 . 0.044 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.832 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.434 1.673 0 C5'-C4'-C3' 110.982 -3.012 . 0.215 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.832 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.349 0 C5'-C4'-C3' 111.05 -2.967 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.805 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.9 0 C5'-C4'-C3' 111.175 -2.883 . 0.03 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.73 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.257 0 O4'-C1'-N19 111.218 3.018 . 0.051 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.622 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.298 0 O4'-C1'-N19 111.442 3.242 . 0.389 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.533 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.242 0 O4'-C1'-N19 110.982 2.782 . 0.18 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.533 ' C6 ' ' C6 ' ' A' ' 25' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.531 0 O4'-C1'-N19 111.122 2.922 . 0.119 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.474 " C5'" " O2'" ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.111 0 O4'-C1'-N19 111.235 3.035 . 0.131 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.581 " O2'" " O5'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.382 0 C3'-C2'-C1' 104.338 3.153 . 0.094 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.983 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.357 0 O4'-C1'-N19 111.294 3.094 . 0.174 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.983 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.161 0 O4'-C1'-N19 111.302 3.102 . 0.282 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.886 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.528 0 O4'-C1'-N19 111.288 3.088 . 0.303 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.576 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.261 0 C5'-C4'-C3' 111.158 -2.894 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 364' ' ' GLY . . . . . 0.404 ' O ' ' CG ' ' B' ' 429' ' ' GLU . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.527 -0.229 . . . . 0.0 112.527 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.81 51.04 1.94 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.842 0.353 . . . . 0.0 110.879 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.469 HD23 ' SD ' ' B' ' 368' ' ' MET . 0.6 OUTLIER -135.19 130.83 35.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.816 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.7 OUTLIER -53.83 -69.63 0.12 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.495 179.655 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.491 ' O ' ' HB2' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -40.76 -42.67 1.82 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.587 179.662 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -63.84 -36.92 85.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.521 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.645 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -68.54 -74.26 0.13 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.605 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.434 ' C ' ' O ' ' B' ' 370' ' ' ALA . 0.1 OUTLIER -37.11 -44.08 0.53 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.076 0.465 . . . . 0.0 110.274 179.67 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.554 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.6 OUTLIER -64.31 -42.65 96.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.764 179.695 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.515 ' HA ' ' HB2' ' B' ' 377' ' ' LEU . 0.4 OUTLIER -57.34 -42.83 82.72 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.174 0.512 . . . . 0.0 110.563 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.569 ' CD2' HD12 ' B' ' 432' ' ' LEU . 0.4 OUTLIER -64.69 -72.79 0.14 Allowed 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -178.62 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 4.6 m-30 -79.54 -25.02 41.78 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -177.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -91.08 -31.71 16.15 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.872 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.941 ' O ' HD13 ' B' ' 378' ' ' ILE . 4.6 mm? -110.85 -13.63 14.11 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.711 -0.396 . . . . 0.0 112.056 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.941 HD13 ' O ' ' B' ' 377' ' ' LEU . 12.5 mm -141.99 -121.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.678 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.516 ' C ' ' O ' ' B' ' 378' ' ' ILE . . . -13.9 82.2 0.0 OUTLIER Glycine 0 C--N 1.343 0.971 0 N-CA-C 114.13 0.412 . . . . 0.0 114.13 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.669 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 0.6 OUTLIER -74.27 -58.97 2.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.764 0.316 . . . . 0.0 110.317 179.591 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.669 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 155.28 34.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.481 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.98 16.95 0.67 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.657 0.265 . . . . 0.0 111.188 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.929 HD13 ' HB2' ' B' ' 385' ' ' LEU . 0.2 OUTLIER -123.87 26.16 7.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.975 0.417 . . . . 0.0 110.635 179.565 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.474 ' HG3' ' HA3' ' B' ' 407' ' ' GLY . 0.0 OUTLIER 36.79 41.28 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.15 179.858 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.929 ' HB2' HD13 ' B' ' 383' ' ' LEU . 1.1 tt -69.2 132.62 46.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.978 0.418 . . . . 0.0 110.752 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 -169.05 135.25 1.7 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.298 0.57 . . . . 0.0 112.194 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.609 ' OH ' ' HB2' ' B' ' 431' ' ' ALA . 2.3 m-85 -84.41 178.55 7.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.325 -0.852 . . . . 0.0 108.741 178.122 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.656 HG23 ' O ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -153.6 108.57 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.297 0.57 . . . . 0.0 112.153 178.525 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.2 m -72.18 100.04 2.48 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.269 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.809 HG23 HG23 ' B' ' 401' ' ' ILE . 32.6 m -107.96 148.66 11.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.234 0.54 . . . . 0.0 111.116 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.464 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 15.1 tptt 80.82 55.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.406 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.443 ' C ' ' O ' ' B' ' 391' ' ' LYS . 3.0 mmpt? -33.88 131.33 0.4 Allowed Pre-proline 0 C--N 1.332 -0.152 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.555 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.537 ' HA ' ' O ' ' B' ' 398' ' ' PRO . 52.2 Cg_exo -53.74 174.42 0.15 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.554 2.169 . . . . 0.0 112.912 -178.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.527 ' OG1' ' N ' ' B' ' 397' ' ' ASP . 3.8 p -140.99 151.4 44.11 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.512 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -76.76 -5.37 47.86 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.137 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 396' ' ' VAL . . . . . 0.583 HG12 " O2'" ' A' ' 30' ' ' ' C' . 35.7 m -125.39 9.46 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.485 0.659 . . . . 0.0 110.073 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.527 ' N ' ' OG1' ' B' ' 394' ' ' THR . 7.5 m-20 179.18 63.19 0.11 Allowed Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 114.918 -1.037 . . . . 0.0 109.687 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.537 ' O ' ' HA ' ' B' ' 393' ' ' PRO . 39.7 Cg_exo -31.27 -65.99 0.08 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.333 2.689 . . . . 0.0 112.618 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.513 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 14.3 m120 7.71 116.6 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 400' ' ' SER . . . . . 0.485 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 0.3 OUTLIER -134.14 149.74 51.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.577 178.503 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.809 HG23 HG23 ' B' ' 390' ' ' VAL . 1.3 tp -127.36 130.09 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 121.324 0.583 . . . . 0.0 112.478 -178.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.73 ' O ' HG22 ' B' ' 414' ' ' THR . 0.7 OUTLIER -91.47 161.44 2.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.182 179.501 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.656 ' O ' HG23 ' B' ' 388' ' ' VAL . 0.8 OUTLIER -138.58 96.83 3.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.97 0.414 . . . . 0.0 111.239 179.348 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -77.83 112.68 14.95 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.69 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.684 ' HD3' HG22 ' B' ' 411' ' ' VAL . 35.9 ttp180 -147.05 161.84 40.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.138 0.494 . . . . 0.0 111.551 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.681 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -130.56 128.8 63.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.149 -179.184 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 407' ' ' GLY . . . . . 0.474 ' HA3' ' HG3' ' B' ' 384' ' ' ARG . . . -30.03 -34.48 0.01 OUTLIER Glycine 0 C--N 1.334 0.442 0 C-N-CA 121.284 -0.484 . . . . 0.0 113.686 -179.314 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 408' ' ' ASP . . . . . 0.514 ' N ' ' O ' ' B' ' 406' ' ' VAL . 6.5 m-20 -55.19 -18.51 6.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.059 0.457 . . . . 0.0 110.386 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 99.35 32.35 5.81 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.834 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.571 ' HB ' HG23 ' B' ' 406' ' ' VAL . 40.0 m -122.19 121.38 36.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.964 0.412 . . . . 0.0 111.53 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.684 HG22 ' HD3' ' B' ' 405' ' ' ARG . 38.6 t -90.29 84.67 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.439 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.796 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -43.06 -23.32 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.34 -179.598 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.445 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 161.61 -174.01 38.07 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.013 -1.089 . . . . 0.0 113.044 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.73 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -143.08 171.73 13.67 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.714 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -160.7 144.06 9.58 Favored Glycine 0 C--O 1.221 -0.692 0 C-N-CA 119.779 -1.2 . . . . 0.0 113.16 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 5.0 p -132.86 155.01 40.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.513 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -170.3 151.65 17.03 Favored Glycine 0 N--CA 1.453 -0.187 0 C-N-CA 120.02 -1.086 . . . . 0.0 113.293 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.514 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 2.3 mtm-85 -70.51 -55.26 9.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.907 0.384 . . . . 0.0 110.499 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.879 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.1 OUTLIER -75.63 -21.65 57.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.888 179.217 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.879 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 98.14 -41.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.113 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.144 -179.291 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.596 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -52.95 -40.41 63.64 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.579 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.688 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -59.14 -35.92 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.748 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 177.355 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.644 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -68.73 -36.65 78.68 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.016 178.14 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.76 -67.14 2.15 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.952 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.41 ' O ' ' HB3' ' B' ' 428' ' ' ALA . 2.4 mp -53.81 -48.3 61.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.598 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -50.08 -49.57 51.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.178 179.402 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.539 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -49.68 -44.63 48.01 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.144 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.677 ' O ' HD13 ' B' ' 432' ' ' LEU . . . -57.35 -68.07 0.27 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.552 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.407 ' HA ' HD11 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -43.6 -25.6 0.18 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.668 179.791 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.445 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 11.3 m-80 -79.6 -32.88 41.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.712 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.609 ' HB2' ' OH ' ' B' ' 387' ' ' TYR . . . -65.52 -40.99 93.6 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 120.87 0.367 . . . . 0.0 110.517 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.902 ' O ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -95.85 25.86 4.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.479 0.657 . . . . 0.0 109.905 179.032 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 6.1 ttt180 -96.38 -8.83 31.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.087 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -101.16 96.68 7.37 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.788 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.523 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 4.4 ptpp? -51.78 -51.11 58.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.259 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.523 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 8.6 mmtt -56.25 -50.12 72.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.98 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.796 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -66.61 -43.49 84.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.93 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.902 HD11 ' O ' ' B' ' 432' ' ' LEU . 35.8 mt -61.72 -55.73 27.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.22 0.534 . . . . 0.0 111.103 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 439' ' ' ASP . . . . . 0.507 ' O ' ' HG3' ' B' ' 443' ' ' LYS . 20.2 t70 -65.39 -27.35 68.49 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.169 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -59.79 -47.43 85.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.949 -0.568 . . . . 0.0 109.994 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.626 ' HB2' HG23 ' B' ' 378' ' ' ILE . 60.8 m-85 -75.02 -35.43 61.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.592 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -48.57 -51.85 25.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.947 0.403 . . . . 0.0 110.075 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 443' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' B' ' 439' ' ' ASP . 0.0 OUTLIER -72.65 -46.93 51.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.873 179.035 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.603 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.7 OUTLIER -53.69 -19.18 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.697 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.588 HH11 HD11 ' B' ' 448' ' ' ILE . 0.2 OUTLIER -87.52 -57.06 3.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.808 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -54.24 -22.25 11.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.122 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . -81.39 -59.47 2.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.11 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.603 HG23 ' O ' ' B' ' 444' ' ' GLN . 6.1 pt -39.01 133.03 1.12 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.259 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 449' ' ' PRO . . . . . 0.462 ' O ' ' O ' ' B' ' 448' ' ' ILE . 73.5 Cg_exo -50.06 -164.44 0.0 OUTLIER 'Trans proline' 0 C--O 1.231 0.136 0 C-N-CA 122.965 2.443 . . . . 0.0 112.515 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -100.84 -58.8 1.82 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.047 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 5.4 m -120.8 169.91 9.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.082 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -73.88 149.17 41.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.565 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 87.2 p . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.92 -179.679 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.809 HO2' ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.827 0 O4'-C1'-N19 111.438 3.238 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.843 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.071 0 O4'-C1'-N19 111.156 2.956 . 0.367 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.843 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.462 0 C5'-C4'-C3' 111.249 -2.834 . 0.13 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.539 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.252 0 O4'-C1'-N19 111.337 3.137 . 0.119 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.652 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 1.973 0 C5'-C4'-C3' 111.224 -2.85 . 0.028 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.503 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.346 0 C5'-C4'-C3' 111.18 -2.88 . 0.165 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.744 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 P--O5' 1.611 1.802 0 C5'-C4'-C3' 110.994 -3.004 . 0.133 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.699 ' N4 ' ' N4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.648 0 C3'-C2'-C1' 104.827 3.697 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.593 " O5'" " O2'" ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.1 0 O4'-C1'-N19 111.035 2.835 . 0.019 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.593 " O2'" " C5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.356 0 C5'-C4'-C3' 111.12 -2.92 . 0.057 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.649 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.359 0 O4'-C1'-N19 111.138 2.938 . 0.046 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.686 ' H6 ' " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.932 0 C5'-C4'-C3' 110.856 -3.096 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.721 " O2'" " H5'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.181 0 O4'-C1'-N19 111.515 3.315 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.721 " H5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.206 0 C5'-C4'-C3' 111.355 -2.763 . 0.452 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.651 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.906 0 C5'-C4'-C3' 110.806 -3.129 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.651 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.848 0 O4'-C1'-N19 111.61 3.41 . 0.28 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.561 " O2'" ' N9 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.776 0 C5'-C4'-C3' 110.942 -3.038 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.561 ' N9 ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.728 0 C5'-C4'-C3' 110.866 -3.09 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.514 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.095 0 C5'-C4'-C3' 111.083 -2.944 . 0.295 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.813 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 P--O5' 1.609 1.632 0 C5'-C4'-C3' 110.95 -3.033 . 0.179 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.813 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.443 0 C3'-C2'-C1' 104.447 3.275 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.843 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.612 1.916 0 O4'-C1'-N19 111.269 3.069 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.66 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.183 0 O4'-C1'-N19 111.815 3.615 . 0.026 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.631 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.236 0 O4'-C1'-N19 110.989 2.789 . 0.127 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.572 " H5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.273 0 O4'-C1'-N19 111.35 3.15 . 0.237 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.538 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.548 0 C5'-C4'-C3' 111.314 -2.791 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.597 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.161 0 O4'-C1'-N19 111.083 2.883 . 0.156 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.597 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.047 0 O4'-C1'-N19 111.408 3.208 . 0.434 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.794 " H2'" " O4'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.238 0 C5'-C4'-C3' 111.413 -2.725 . 0.075 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 1.017 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.21 0 O4'-C1'-N19 111.39 3.19 . 0.395 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 1.017 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.574 0 C3'-C2'-C1' 104.14 2.933 . 0.164 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.545 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.437 0 O4'-C1'-N19 111.134 2.934 . 0.341 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 364' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' B' ' 365' ' ' SER . . . . . . . . 0 N--CA 1.489 2.183 0 N-CA-C 112.59 -0.204 . . . . 0.0 112.59 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 365' ' ' SER . . . . . 0.401 ' C ' ' O ' ' B' ' 364' ' ' GLY . 87.9 p 36.67 56.93 1.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.863 0.363 . . . . 0.0 111.213 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.738 HD23 ' SD ' ' B' ' 368' ' ' MET . 1.8 tp -132.42 126.6 33.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.864 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.9 OUTLIER -54.01 -68.77 0.15 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.888 0.375 . . . . 0.0 110.12 179.573 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.738 ' SD ' HD23 ' B' ' 366' ' ' LEU . 0.0 OUTLIER -34.59 -45.56 0.25 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.429 179.772 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' B' ' 366' ' ' LEU . 93.9 m-20 -59.39 -48.01 83.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.509 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 1.025 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -62.33 -75.28 0.08 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.581 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -31.58 -41.92 0.05 OUTLIER 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.105 -179.673 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.58 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.4 OUTLIER -65.44 -45.59 83.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.346 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.608 ' OE1' HD13 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -58.91 -39.58 81.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.177 0.513 . . . . 0.0 111.153 -179.792 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.48 HD11 ' OH ' ' B' ' 387' ' ' TYR . 1.3 mm? -67.66 -71.09 0.22 Allowed 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.505 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-30 -87.37 5.88 36.45 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -177.325 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.58 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -122.56 -20.35 6.04 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.103 179.321 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.772 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.8 OUTLIER -116.15 -27.42 6.9 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.453 179.75 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.772 HD13 ' O ' ' B' ' 377' ' ' LEU . 3.7 mm -142.07 33.58 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.112 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.505 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -122.28 86.27 0.39 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.72 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.535 ' CD2' ' HD3' ' B' ' 445' ' ' ARG . 5.1 p90 -97.86 167.63 10.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.726 0.298 . . . . 0.0 110.491 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.55 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -66.9 114.86 6.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.916 0.389 . . . . 0.0 111.714 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.55 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.4 p 90.42 44.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.881 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.507 ' CD1' ' O ' ' B' ' 378' ' ' ILE . 1.0 OUTLIER -92.61 -40.41 10.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.939 0.4 . . . . 0.0 110.684 179.657 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.446 ' CB ' ' O ' ' B' ' 383' ' ' LEU . 2.0 tpt180 81.78 -8.95 1.28 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.106 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.815 ' HA ' HG12 ' B' ' 406' ' ' VAL . 7.9 tt -40.83 136.02 1.53 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.493 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.523 ' N ' HD23 ' B' ' 385' ' ' LEU . 9.1 p-80 -164.11 148.85 10.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.541 0.686 . . . . 0.0 112.577 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.514 ' CD2' ' HB1' ' B' ' 427' ' ' ALA . 2.8 m-85 -101.23 141.95 33.37 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.989 179.112 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.666 HG23 ' HB2' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -121.25 120.02 60.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.16 0.505 . . . . 0.0 111.324 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 10.6 m -76.27 134.38 39.8 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.77 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.983 HG23 HG23 ' B' ' 401' ' ' ILE . 20.8 m -141.14 157.78 22.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.874 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.636 ' HB2' HG22 ' B' ' 401' ' ' ILE . 4.5 tmtt? 85.99 62.6 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.21 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.461 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER -29.47 125.92 0.26 Allowed Pre-proline 0 C--N 1.334 -0.075 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.001 -179.492 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.478 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 8.1 Cg_exo -70.39 161.16 47.02 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.559 2.173 . . . . 0.0 113.023 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.439 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 1.6 p -135.78 165.49 25.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.92 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 395' ' ' ALA . . . . . 0.472 ' O ' " O2'" ' A' ' 30' ' ' ' C' . . . -90.97 19.86 5.32 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.361 0.6 . . . . 0.0 110.478 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 14.5 m -139.78 14.19 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.329 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.478 ' H ' ' CD ' ' B' ' 398' ' ' PRO . 4.6 m-20 163.82 54.63 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.839 -179.48 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.515 ' HB3' " O4'" ' A' ' 5' ' ' ' U' . 5.2 Cg_exo -40.15 -25.56 0.17 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.509 2.806 . . . . 0.0 112.818 -179.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 52.5 p30 -30.99 148.41 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.328 0.585 . . . . 0.0 112.082 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -155.26 155.85 34.53 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.281 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.983 HG23 HG23 ' B' ' 390' ' ' VAL . 0.2 OUTLIER -108.49 152.8 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.448 179.707 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.702 HG23 ' HB1' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -123.48 142.69 39.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.736 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.666 ' HB2' HG23 ' B' ' 388' ' ' VAL . 1.8 mt-10 -108.29 128.4 54.71 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 179.161 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.545 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.8 OUTLIER -108.09 109.57 21.04 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.099 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.73 ' HB3' HG22 ' B' ' 411' ' ' VAL . 0.0 OUTLIER -145.59 -156.68 0.73 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.181 0.515 . . . . 0.0 111.704 -178.894 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.815 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -151.86 143.34 15.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.271 -179.443 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -38.23 -27.56 0.04 OUTLIER Glycine 0 C--N 1.332 0.353 0 CA-C-N 115.612 -0.722 . . . . 0.0 113.361 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 408' ' ' ASP . . . . . 0.575 ' OD1' HG23 ' B' ' 406' ' ' VAL . 47.0 p30 -69.51 -4.71 20.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.812 0.339 . . . . 0.0 110.878 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 409' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 85.04 39.33 8.61 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.156 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.564 ' HB ' HG23 ' B' ' 406' ' ' VAL . 12.8 m -127.31 118.29 23.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.724 0.297 . . . . 0.0 111.659 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.73 HG22 ' HB3' ' B' ' 405' ' ' ARG . 52.1 t -92.96 112.1 25.67 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.807 179.364 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.613 ' HG ' ' HE1' ' B' ' 437' ' ' MET . 0.5 OUTLIER -67.24 -37.64 83.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.383 179.418 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.49 ' O ' ' HB ' ' B' ' 414' ' ' THR . . . -174.35 -150.66 7.82 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.505 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.49 ' HB ' ' O ' ' B' ' 413' ' ' GLY . 13.2 t 176.09 155.3 0.21 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.694 0.283 . . . . 0.0 111.028 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.502 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -150.52 -177.18 24.2 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.461 -0.876 . . . . 0.0 112.796 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 2.2 p -153.16 161.55 2.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.796 0.331 . . . . 0.0 110.926 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.981 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -166.21 171.63 41.31 Favored Glycine 0 C--O 1.225 -0.454 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.933 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.443 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.0 OUTLIER -83.64 -39.92 19.64 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 117.067 0.434 . . . . 0.0 111.362 -179.857 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.85 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -104.44 31.81 4.43 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.048 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.56 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.33 -45.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 178.875 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.631 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -45.9 -49.35 15.67 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.296 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.981 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.49 -40.62 7.08 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.62 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.935 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.702 ' HB1' HG23 ' B' ' 402' ' ' VAL . . . -65.77 -40.42 91.99 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.485 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.92 -67.91 1.89 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.552 -0.832 . . . . 0.0 111.227 178.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.515 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 1.1 mp -52.52 -47.27 48.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.602 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 11.4 tpt180 -51.37 -47.95 62.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.72 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.622 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -47.36 -49.52 24.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.46 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 1.025 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -56.34 -57.66 11.31 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.656 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.657 ' HA ' HD21 ' B' ' 432' ' ' LEU . 0.5 OUTLIER -49.36 -20.05 0.61 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.712 179.257 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.504 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 4.3 m-80 -83.86 -36.91 23.08 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.916 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.4 ' HB3' HD21 ' B' ' 374' ' ' LEU . . . -65.42 -40.69 93.65 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.857 0.36 . . . . 0.0 111.167 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.8 HD13 ' O ' ' B' ' 428' ' ' ALA . 0.0 OUTLIER -89.57 9.41 26.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.98 179.89 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.528 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 23.8 ttm180 -89.97 3.74 52.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.077 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.456 ' HB3' ' CB ' ' B' ' 437' ' ' MET . 48.3 m-20 -115.09 87.34 2.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.896 0.379 . . . . 0.0 111.116 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.531 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -50.19 -51.23 45.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.987 179.506 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.531 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -57.94 -43.84 86.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.602 179.61 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.613 ' HE1' ' HG ' ' B' ' 412' ' ' LEU . 9.2 tmm? -66.48 -49.67 65.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.134 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.608 HD13 ' OE1' ' B' ' 373' ' ' GLN . 47.4 mt -54.91 -63.31 1.19 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.042 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -56.22 -31.1 63.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.938 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.3 OUTLIER -59.22 -38.95 81.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.105 179.723 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.436 ' O ' ' HB2' ' B' ' 445' ' ' ARG . 43.3 m-85 -82.62 -21.09 35.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.782 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -67.47 -52.48 38.77 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -61.69 -45.0 95.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.502 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 1.01 ' O ' HG23 ' B' ' 448' ' ' ILE . 3.2 mt-30 -59.63 -52.96 63.28 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.941 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.535 ' HD3' ' CD2' ' B' ' 380' ' ' TYR . 0.1 OUTLIER -40.47 -51.4 2.88 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.718 179.168 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -72.52 -31.58 65.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.15 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.514 ' O ' ' HD3' ' B' ' 449' ' ' PRO . . . -117.06 57.11 0.8 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.552 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 1.01 HG23 ' O ' ' B' ' 444' ' ' GLN . 17.3 pt -102.18 102.87 26.86 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-O 121.117 0.484 . . . . 0.0 111.243 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 449' ' ' PRO . . . . . 0.514 ' HD3' ' O ' ' B' ' 447' ' ' ALA . 31.7 Cg_exo -59.51 -146.55 0.01 OUTLIER 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 123.097 2.531 . . . . 0.0 112.603 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 27.1 ptt85 -54.76 -169.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.167 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -157.02 128.98 7.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.609 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -150.9 131.07 13.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.936 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 59.3 p . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.856 179.979 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 1.006 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.633 0 O4'-C1'-N19 111.207 3.007 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 1.006 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.229 0 O4'-C1'-N19 111.327 3.127 . 0.099 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.614 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.638 0 C3'-C2'-C1' 105.057 3.953 OUTLIER-DELTA 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.614 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.31 0 C5'-C4'-C3' 111.225 -2.85 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.584 " O2'" " H5'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.134 0 O4'-C1'-N19 111.155 2.955 . 0.122 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.584 " H5'" " O2'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.358 0 C5'-C4'-C3' 111.155 -2.897 . 0.162 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.583 " C5'" " O2'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.946 0 O4'-C1'-N19 111.331 3.131 . 0.042 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.49 " H2'" " O4'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 P--O5' 1.614 2.086 0 O4'-C1'-N19 110.888 2.688 . 0.111 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.724 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.486 0 C5'-C4'-C3' 111.278 -2.815 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.724 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.744 0 C3'-C2'-C1' 104.615 3.461 . 0.073 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.665 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 O4'-C1'-N19 111.096 2.896 . 0.038 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.702 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.797 0 C5'-C4'-C3' 111.048 -2.968 . 0.031 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.702 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 O4'-C1'-N19 111.433 3.233 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.661 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.114 0 O4'-C1'-N19 111.184 2.984 . 0.221 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.873 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.909 0 C5'-C4'-C3' 111.133 -2.912 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.873 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.609 1.624 0 O4'-C1'-N19 111.789 3.589 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.77 ' OP2' " H4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -1.966 0 C5'-C4'-C3' 110.677 -3.216 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.699 ' P ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.716 0 C5'-C4'-C3' 111.213 -2.858 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.604 " O2'" " C5'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 1.978 0 C5'-C4'-C3' 111.125 -2.917 . 0.05 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.822 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.865 0 C5'-C4'-C3' 111.004 -2.997 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.822 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.287 0 C5'-C4'-C3' 111.074 -2.951 . 0.047 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.865 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.867 0 O4'-C1'-N19 111.218 3.018 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.702 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.177 0 O4'-C1'-N19 111.076 2.876 . 0.019 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.66 ' C4 ' ' C6 ' ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.641 0 C3'-C2'-C1' 104.883 3.759 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.594 " C5'" HO2' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.271 0 O4'-C1'-N19 111.276 3.076 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.653 HO2' " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.508 0 O4'-C1'-N19 111.339 3.139 . 0.145 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.909 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.072 0 O4'-C1'-N19 111.027 2.827 . 0.104 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.909 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.591 1 C3'-C2'-C1' 105.199 4.11 OUTLIER-DELTA 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.929 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.021 0 O4'-C1'-N19 111.063 2.863 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.929 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.376 0 O4'-C1'-N19 111.65 3.45 . 0.343 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.667 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.772 0 C3'-C2'-C1' 104.335 3.15 . 0.076 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.638 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.588 0 C5'-C4'-C3' 111.129 -2.914 . 0.452 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.14 0 N-CA-C 112.543 -0.223 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 53.72 24.61 4.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.773 0.32 . . . . 0.0 111.047 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.856 HD22 ' ND2' ' B' ' 369' ' ' ASN . 0.2 OUTLIER -117.95 114.32 23.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.065 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.589 ' OD1' HD12 ' B' ' 425' ' ' ILE . 7.3 t0 -56.57 -67.88 0.27 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.464 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.443 ' C ' ' O ' ' B' ' 367' ' ' ASP . 0.9 OUTLIER -33.49 -52.57 0.39 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.72 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.856 ' ND2' HD22 ' B' ' 366' ' ' LEU . 66.2 m-20 -60.0 -42.73 94.88 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.401 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.836 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -61.35 -78.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.796 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -32.03 -44.75 0.09 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.834 -179.606 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.506 ' O ' ' HB2' ' B' ' 376' ' ' SER . 0.0 OUTLIER -58.62 -58.93 6.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.355 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 1.072 ' NE2' HD23 ' B' ' 377' ' ' LEU . 2.4 tm0? -47.28 -56.13 7.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.331 0.586 . . . . 0.0 110.974 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.732 ' N ' HD23 ' B' ' 374' ' ' LEU . 2.0 mt -46.39 -69.76 0.12 Allowed 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -178.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -89.77 -45.16 9.48 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -176.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.506 ' HB2' ' O ' ' B' ' 372' ' ' ARG . 49.6 m -67.48 -20.78 65.51 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.753 -179.071 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 1.072 HD23 ' NE2' ' B' ' 373' ' ' GLN . 2.1 tp -110.82 -39.25 4.89 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 120.639 0.257 . . . . 0.0 110.836 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.615 HG22 ' H ' ' B' ' 379' ' ' GLY . 1.9 mm -126.91 -151.42 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.615 ' H ' HG22 ' B' ' 378' ' ' ILE . . . 40.81 64.85 1.14 Allowed Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.532 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.779 ' CE2' HG21 ' B' ' 448' ' ' ILE . 4.2 p90 -81.36 -61.74 1.86 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.558 0.179 . . . . 0.0 111.307 -179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.706 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 160.15 71.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 8.7 t 156.21 21.89 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.559 HD23 ' H ' ' B' ' 383' ' ' LEU . 0.8 OUTLIER -117.4 -26.39 6.7 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 122.063 -0.398 . . . . 0.0 110.949 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.497 ' HB3' ' O ' ' B' ' 383' ' ' LEU . 8.7 tpp180 79.59 48.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.552 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.74 HD23 ' N ' ' B' ' 386' ' ' HIS . 5.2 tt -84.25 132.57 34.63 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.031 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.74 ' N ' HD23 ' B' ' 385' ' ' LEU . 13.1 p-80 -164.94 147.8 8.36 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -179.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.463 ' CZ ' ' SG ' ' B' ' 404' ' ' CYS . 7.4 m-85 -103.26 144.92 30.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.133 178.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.611 HG23 ' HB2' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -123.97 125.17 70.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.167 0.508 . . . . 0.0 110.799 179.229 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.4 m -83.92 126.18 32.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.964 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.698 HG23 ' CG2' ' B' ' 401' ' ' ILE . 27.2 m -134.39 155.32 38.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.812 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.518 ' HB3' ' O ' ' B' ' 390' ' ' VAL . 11.6 tptp 86.82 57.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.599 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER -33.87 122.02 0.49 Allowed Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.515 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.438 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 17.1 Cg_exo -63.14 162.33 26.76 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.608 2.205 . . . . 0.0 112.701 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.9 p -134.49 170.14 16.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.888 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 395' ' ' ALA . . . . . 0.402 ' CB ' ' O2 ' ' A' ' 29' ' ' ' U' . . . -93.47 16.93 12.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.833 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 29.5 m -135.9 11.8 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.441 178.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.433 ' O ' ' N ' ' B' ' 399' ' ' ASN . 1.1 m-20 163.78 64.84 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.218 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.58 ' HB3' " C4'" ' A' ' 5' ' ' ' U' . 4.7 Cg_exo -37.05 -28.88 0.08 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 123.557 2.838 . . . . 0.0 112.363 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.497 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 8.3 m120 -21.91 121.88 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.483 -0.781 . . . . 0.0 112.347 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 5.9 t -143.22 154.5 43.91 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.795 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.698 ' CG2' HG23 ' B' ' 390' ' ' VAL . 16.8 tt -120.26 159.08 21.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.343 0.592 . . . . 0.0 111.381 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.847 ' O ' HG22 ' B' ' 414' ' ' THR . 0.2 OUTLIER -121.08 152.61 24.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.276 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.611 ' HB2' HG23 ' B' ' 388' ' ' VAL . 32.3 mt-10 -122.12 125.31 45.9 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.981 0.42 . . . . 0.0 110.107 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.624 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 48.3 t -110.4 111.84 23.38 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.582 ' HB3' HG22 ' B' ' 411' ' ' VAL . 15.3 ptp180 -145.85 -175.86 4.91 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.232 0.539 . . . . 0.0 111.651 -179.183 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.618 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -146.68 144.96 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.134 -179.388 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 407' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' B' ' 408' ' ' ASP . . . 66.54 6.24 34.03 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.265 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 408' ' ' ASP . . . . . 0.498 ' HB3' ' O ' ' B' ' 407' ' ' GLY . 59.8 t0 74.85 39.66 0.4 Allowed 'General case' 0 C--O 1.23 0.078 0 CA-C-O 120.639 0.257 . . . . 0.0 111.536 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -167.12 -50.66 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.303 -0.951 . . . . 0.0 113.054 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.618 ' HB ' HG23 ' B' ' 406' ' ' VAL . 17.6 m -72.97 94.98 1.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.598 0.237 . . . . 0.0 111.2 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.582 HG22 ' HB3' ' B' ' 405' ' ' ARG . 95.4 t -82.82 111.46 19.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.786 0.327 . . . . 0.0 111.294 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.558 HD22 ' HA ' ' B' ' 405' ' ' ARG . 0.7 OUTLIER -65.44 -32.84 74.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.368 179.149 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.404 ' HA3' ' OD1' ' B' ' 430' ' ' ASN . . . 178.55 -158.25 22.63 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.608 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.847 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -156.19 167.67 29.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.791 0.329 . . . . 0.0 111.146 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.667 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -159.42 124.59 1.37 Allowed Glycine 0 C--O 1.225 -0.464 0 C-N-CA 120.531 -0.843 . . . . 0.0 112.572 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.438 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 10.1 p -124.33 151.88 29.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.778 0.323 . . . . 0.0 110.842 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.946 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -167.03 159.49 32.89 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.212 -0.994 . . . . 0.0 113.284 -179.624 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.4 OUTLIER -67.18 -45.68 76.21 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.402 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.822 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -98.68 30.17 3.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.215 0.531 . . . . 0.0 109.586 179.078 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.63 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 50.41 -44.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 115.227 1.566 . . . . 0.0 115.227 178.319 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.621 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -47.43 -48.93 26.24 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.595 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.946 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.06 -37.23 3.84 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.628 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.169 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -69.02 -46.51 67.77 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.698 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.97 -59.34 10.95 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.429 -0.891 . . . . 0.0 111.424 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.784 ' N ' HD13 ' B' ' 425' ' ' ILE . 1.2 mm -60.93 -40.15 84.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.804 0.335 . . . . 0.0 110.806 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.585 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 25.2 tpt180 -57.41 -42.09 81.6 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.376 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.643 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -62.12 -45.26 94.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.394 179.469 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.836 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -56.16 -59.47 4.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.37 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.49 ' O ' ' HB2' ' B' ' 433' ' ' ARG . 1.0 OUTLIER -50.73 -31.46 16.71 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.127 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.501 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -63.86 -39.74 94.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.646 179.532 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.624 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -65.0 -41.62 95.21 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 120.993 0.425 . . . . 0.0 110.324 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.673 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.3 OUTLIER -86.24 9.12 18.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.592 179.353 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 2.3 ttm-85 -93.99 11.4 29.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.767 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.553 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 2.3 m-20 -125.39 79.81 1.84 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.805 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.505 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 10.4 ptpt -46.27 -48.9 17.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.016 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.505 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 3.3 mtpp -57.62 -46.62 83.9 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.817 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.553 ' HB3' ' HB2' ' B' ' 434' ' ' ASP . 1.5 tmm? -64.27 -65.12 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.049 0.452 . . . . 0.0 109.895 179.184 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.673 HD11 ' HA ' ' B' ' 432' ' ' LEU . 44.6 mt -39.13 -67.59 0.21 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.05 179.285 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -47.8 -43.95 28.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.69 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.464 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -52.64 -32.57 42.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.969 179.868 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.447 ' HB2' ' O ' ' B' ' 438' ' ' LEU . 25.7 m-85 -75.57 -41.33 55.0 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.756 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.426 ' O ' ' HB2' ' B' ' 445' ' ' ARG . . . -49.25 -43.9 43.26 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 443' ' ' LYS . . . . . 0.403 ' HD3' ' N ' ' B' ' 444' ' ' GLN . 0.1 OUTLIER -62.85 -50.45 70.86 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.769 178.512 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.53 ' O ' HG12 ' B' ' 448' ' ' ILE . 1.3 mt-30 -55.52 -36.57 66.87 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.775 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.617 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 5.0 mmm-85 -55.22 -52.9 61.89 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.489 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -58.4 -33.55 69.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.325 0.583 . . . . 0.0 109.465 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.466 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -84.18 -86.13 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.824 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.779 HG21 ' CE2' ' B' ' 380' ' ' TYR . 0.3 OUTLIER 27.14 89.01 0.07 OUTLIER Pre-proline 0 N--CA 1.465 0.279 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.516 -179.125 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -41.46 147.83 0.33 Allowed 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.876 2.384 . . . . 0.0 112.452 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -76.58 -29.2 56.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.396 -179.508 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 29.2 t -120.66 131.27 54.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 0.0 111.084 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -54.43 129.03 34.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.866 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 13.5 p . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.849 179.939 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.671 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 C2'--C1' 1.512 -1.565 0 C5'-C4'-C3' 111.088 -2.942 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.758 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.243 0 O4'-C1'-N19 111.114 2.914 . 0.039 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.758 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.517 0 C3'-C2'-C1' 104.839 3.711 . 0.044 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.628 " C5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.097 0 O4'-C1'-N19 111.372 3.172 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.492 ' C6 ' " H2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.362 0 O4'-C1'-N19 111.218 3.018 . 0.096 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.502 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.184 0 O4'-C1'-N19 111.128 2.928 . 0.194 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.873 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.876 0 O4'-C1'-N19 111.406 3.206 . 0.143 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.575 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.298 0 O4'-C1'-N19 111.088 2.888 . 0.228 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.575 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.508 0 C5'-C4'-C3' 111.257 -2.829 . 0.162 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.687 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.946 0 C5'-C4'-C3' 110.861 -3.093 . 0.093 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.606 " C5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.503 0 O4'-C1'-N19 110.977 2.777 . 0.033 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.934 ' H6 ' " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.818 0 C5'-C4'-C3' 111.037 -2.975 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.807 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.483 0 C3'-C2'-C1' 104.681 3.534 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.647 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.302 0 C5'-C4'-C3' 111.159 -2.894 . 0.149 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.787 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.251 0 C5'-C4'-C3' 111.099 -2.934 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.787 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.124 0 O4'-C1'-N19 111.551 3.351 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.703 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 P--O5' 1.611 1.821 0 C5'-C4'-C3' 110.839 -3.107 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.687 " H2'" " O4'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.436 1.835 0 C5'-C4'-C3' 111.023 -2.985 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.687 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.139 0 C5'-C4'-C3' 111.047 -2.968 . 0.04 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.72 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.723 0 C5'-C4'-C3' 110.898 -3.068 . 0.044 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.696 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.098 0 C5'-C4'-C3' 110.987 -3.009 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.844 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.962 0 O4'-C1'-N19 111.216 3.016 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.795 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.317 0 O4'-C1'-N19 111.762 3.562 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.689 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 P--O5' 1.616 2.261 0 O4'-C1'-N19 110.777 2.577 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.425 ' O6 ' ' O4 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.3 0 O4'-C1'-N19 111.295 3.095 . 0.327 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.649 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.328 0 O4'-C1'-N19 111.172 2.972 . 0.12 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.839 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.946 0 O4'-C1'-N19 111.141 2.941 . 0.257 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.839 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.414 0 C3'-C2'-C1' 104.514 3.349 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.916 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.273 0 O4'-C1'-N19 111.309 3.109 . 0.205 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.916 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.195 0 O4'-C1'-N19 111.613 3.413 . 0.166 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.804 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.268 0 O4'-C1'-N19 111.253 3.053 . 0.101 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.649 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.404 0 O4'-C1'-N19 111.101 2.901 . 0.501 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 N-CA-C 112.604 -0.198 . . . . 0.0 112.604 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 365' ' ' SER . . . . . 0.475 ' HB2' ' OD1' ' B' ' 367' ' ' ASP . 0.3 OUTLIER 49.18 83.16 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.836 0.351 . . . . 0.0 110.622 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.45 ' HA ' HD12 ' B' ' 366' ' ' LEU . 7.0 tp -57.9 -18.31 22.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.456 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.694 ' HA ' HG23 ' B' ' 425' ' ' ILE . 0.4 OUTLIER -38.72 -68.89 0.14 Allowed 'General case' 0 C--O 1.237 0.447 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.36 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.473 ' HE2' ' H ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -32.91 -56.09 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.112 178.93 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.49 HD22 ' N6 ' ' A' ' 17' ' ' ' A' . 0.5 OUTLIER -52.31 -56.1 17.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.376 179.717 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.991 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -43.4 -75.99 0.03 OUTLIER 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.591 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -35.78 -38.07 0.11 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.22 0.533 . . . . 0.0 110.36 179.849 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.545 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.1 tmt_? -59.6 -55.86 29.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.324 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.695 ' HB3' HD22 ' B' ' 432' ' ' LEU . 0.2 OUTLIER -50.4 -32.23 17.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.736 179.614 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.759 HD11 ' OH ' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -71.34 -78.41 0.08 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.714 -178.979 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.543 ' CD2' ' OP1' ' A' ' 20' ' ' ' A' . 3.5 m-30 -79.44 12.76 2.28 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -178.287 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -128.09 -28.46 2.62 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.705 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.993 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.4 OUTLIER -110.03 -16.9 13.71 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.758 -179.646 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.993 HD13 ' O ' ' B' ' 377' ' ' LEU . 13.9 mm -132.35 -60.02 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 121.005 0.431 . . . . 0.0 110.041 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.618 ' HA2' HD12 ' B' ' 383' ' ' LEU . . . -53.04 143.56 25.31 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.146 179.322 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.641 ' CE1' ' CZ ' ' B' ' 445' ' ' ARG . 0.5 OUTLIER -143.95 -48.94 0.29 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.557 -0.322 . . . . 0.0 111.537 179.82 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.526 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 171.76 -26.06 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.46 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.565 ' HB2' ' CE2' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -111.22 -6.51 14.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.808 0.337 . . . . 0.0 110.913 179.817 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.827 HD13 ' HB2' ' B' ' 385' ' ' LEU . 0.1 OUTLIER -48.18 -51.58 24.5 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.923 -179.968 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.484 ' HG2' ' HA3' ' B' ' 407' ' ' GLY . 2.3 tpt180 77.56 6.4 2.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.607 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.827 ' HB2' HD13 ' B' ' 383' ' ' LEU . 3.7 tt -49.54 135.28 18.51 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.793 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.417 ' O ' ' CD2' ' B' ' 386' ' ' HIS . 8.7 p-80 -153.35 134.46 14.06 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.365 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.759 ' OH ' HD11 ' B' ' 374' ' ' LEU . 6.9 m-85 -92.41 140.97 29.04 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.8 179.291 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -125.62 124.61 67.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.977 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 6.9 m -82.19 130.79 35.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.322 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 1.007 HG23 HG23 ' B' ' 401' ' ' ILE . 21.6 m -135.25 160.07 40.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.279 0.562 . . . . 0.0 110.983 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.653 ' CB ' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 73.85 53.7 0.11 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.533 -179.623 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.476 ' C ' ' O ' ' B' ' 391' ' ' LYS . 3.7 mmtp -25.52 136.29 0.08 OUTLIER Pre-proline 0 N--CA 1.464 0.269 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.425 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 393' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -68.55 160.73 48.09 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.26 1.973 . . . . 0.0 112.59 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 1.5 p -127.59 158.79 36.55 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.835 -179.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 395' ' ' ALA . . . . . 0.453 ' O ' " O2'" ' A' ' 30' ' ' ' C' . . . -87.05 14.71 7.0 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.266 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 396' ' ' VAL . . . . . 0.733 HG12 " H5'" ' A' ' 31' ' ' ' U' . 31.2 m -141.51 14.51 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.315 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 168.87 61.13 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 114.697 -1.138 . . . . 0.0 109.284 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.495 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 78.3 Cg_exo -41.8 -31.18 1.29 Allowed 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.329 2.686 . . . . 0.0 113.274 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.554 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.6 p-10 -28.39 119.32 0.12 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.803 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.51 150.41 52.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.578 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 1.007 HG23 HG23 ' B' ' 390' ' ' VAL . 0.2 OUTLIER -107.22 150.38 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.303 -179.897 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.721 ' CG2' ' HB1' ' B' ' 423' ' ' ALA . 0.1 OUTLIER -121.75 153.28 25.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.341 -179.818 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.446 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 7.3 mt-10 -123.69 132.77 53.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.856 0.36 . . . . 0.0 110.174 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.579 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -115.84 115.2 25.84 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.44 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.601 ' HB3' HG22 ' B' ' 411' ' ' VAL . 2.1 ptm180 -143.73 -164.19 1.82 Allowed 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.173 0.511 . . . . 0.0 111.486 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.667 HG12 ' CA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -145.44 144.31 21.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.288 -179.401 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 407' ' ' GLY . . . . . 0.484 ' HA3' ' HG2' ' B' ' 384' ' ' ARG . . . -36.21 -29.96 0.02 OUTLIER Glycine 0 C--N 1.331 0.298 0 CA-C-N 115.744 -0.662 . . . . 0.0 113.309 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 408' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' B' ' 406' ' ' VAL . 2.8 t70 -66.08 -8.23 22.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.77 0.319 . . . . 0.0 110.899 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 409' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 86.68 39.88 7.45 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.462 -179.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.514 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 53.1 m -129.05 116.44 19.3 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.601 HG22 ' HB3' ' B' ' 405' ' ' ARG . 48.1 t -86.19 110.95 20.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.887 178.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.993 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -64.49 -34.75 78.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.356 . . . . 0.0 110.304 179.742 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.449 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . -176.4 -154.9 12.24 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.677 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.467 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 12.9 t -173.78 168.99 4.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.693 0.283 . . . . 0.0 110.743 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.476 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -167.35 167.46 39.91 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.399 -0.905 . . . . 0.0 113.033 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.18 150.82 18.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 122.276 0.23 . . . . 0.0 110.388 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.855 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -160.26 143.5 9.1 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.927 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.495 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 15.1 ptt180 -56.16 -47.04 79.01 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.839 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.5 OUTLIER -99.75 34.38 2.28 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 178.884 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.723 HD12 ' C ' ' B' ' 420' ' ' ILE . 0.5 OUTLIER 46.35 -46.23 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 N-CA-C 115.506 1.669 . . . . 0.0 115.506 178.609 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.686 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -46.01 -48.17 16.7 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 -179.129 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.855 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -48.52 -40.12 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.719 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.109 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.721 ' HB1' ' CG2' ' B' ' 402' ' ' VAL . . . -63.51 -44.28 94.77 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.363 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.07 -65.22 3.23 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.484 -0.865 . . . . 0.0 111.456 178.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.694 HG23 ' HA ' ' B' ' 367' ' ' ASP . 4.4 mm -52.94 -35.85 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.059 0.456 . . . . 0.0 110.382 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.581 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 3.6 tpt180 -63.45 -49.12 74.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.531 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.525 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -51.71 -41.73 61.7 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.287 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.991 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -58.76 -62.22 2.03 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.31 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.524 ' HA ' HD11 ' B' ' 432' ' ' LEU . 0.3 OUTLIER -53.78 -20.44 5.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.244 179.295 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.469 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 1.9 m-80 -76.1 -40.05 53.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.812 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.423 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -64.62 -39.08 93.07 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.253 0.549 . . . . 0.0 109.579 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.916 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.2 OUTLIER -85.19 8.09 19.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.538 179.008 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.408 ' HB2' ' HA ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -87.85 -1.6 58.08 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.276 -179.759 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.552 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 6.3 m-20 -111.44 83.56 1.79 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.918 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.479 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 1.6 ptmm? -50.75 -49.4 58.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.006 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.479 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 4.2 mmtp -61.36 -45.1 95.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.166 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.993 ' SD ' HD12 ' B' ' 412' ' ' LEU . 2.0 ttp -67.63 -51.45 49.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.939 0.4 . . . . 0.0 110.488 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.916 HD11 ' HA ' ' B' ' 432' ' ' LEU . 80.6 mt -51.13 -62.62 1.5 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.213 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -50.99 -38.72 52.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.317 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.725 ' CZ ' ' NE2' ' B' ' 444' ' ' GLN . 0.9 OUTLIER -55.23 -36.8 66.39 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.7 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.665 ' CB ' HG23 ' B' ' 378' ' ' ILE . 32.1 m-85 -73.36 -46.04 51.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.163 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.416 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -41.88 -51.03 4.42 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -64.09 -42.18 97.03 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.725 ' NE2' ' CZ ' ' B' ' 440' ' ' PHE . 3.4 mm-40 -53.59 -42.51 67.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.168 179.018 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.725 ' O ' HD11 ' B' ' 448' ' ' ILE . 40.2 mmt-85 -62.95 -38.73 92.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.624 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -67.59 -42.54 82.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.58 178.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.479 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -72.61 -82.43 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.353 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.725 HD11 ' O ' ' B' ' 445' ' ' ARG . 0.2 OUTLIER 26.82 96.9 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.291 -179.734 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -39.01 157.11 0.03 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.787 2.325 . . . . 0.0 112.689 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.19 -65.91 0.95 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.662 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.52 63.72 1.77 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.803 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -49.68 -44.01 47.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.09 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.261 -0.875 . . . . 0.0 110.946 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.812 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.436 1.814 0 O4'-C1'-N19 111.394 3.194 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.812 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.311 0 O4'-C1'-N19 111.184 2.984 . 0.083 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.642 " O2'" " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 C5'-C4'-C3' 111.074 -2.951 . 0.134 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.642 " C5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 P--O5' 1.613 1.987 0 O4'-C1'-N19 111.084 2.884 . 0.169 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.437 " C5'" ' HB3' ' B' ' 398' ' ' PRO . . . . . . . . 0 O4'--C4' 1.427 -2.143 0 C5'-C4'-C3' 111.06 -2.96 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.516 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.246 0 O4'-C1'-N19 111.481 3.281 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.787 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.056 0 O4'-C1'-N19 111.275 3.075 . 0.17 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.528 ' C4 ' ' N7 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.299 0 O4'-C1'-N19 111.106 2.906 . 0.331 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.528 ' N7 ' ' C4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.508 0 C5'-C4'-C3' 111.445 -2.703 . 0.128 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.443 ' C6 ' " H2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.04 0 O4'-C1'-N19 111.255 3.055 . 0.107 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.629 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.446 0 C5'-C4'-C3' 111.392 -2.739 . 0.07 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.796 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.876 0 O4'-C1'-N19 111.11 2.91 . 0.051 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.796 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.516 0 C3'-C2'-C1' 104.678 3.531 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.793 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.357 0 C5'-C4'-C3' 110.995 -3.004 . 0.052 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.869 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.428 -2.108 0 C5'-C4'-C3' 111.051 -2.966 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.869 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.226 0 O4'-C1'-N19 111.588 3.388 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.742 HO2' " C1'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.849 0 C5'-C4'-C3' 110.871 -3.086 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.742 " C1'" HO2' ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.953 0 C5'-C4'-C3' 111.128 -2.915 . 0.0 OUTLIER '7D dist 4n' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.622 ' H21' ' NZ ' ' B' ' 371' ' ' LYS . . . . . . . . 0 O4'--C1' 1.437 1.89 0 C5'-C4'-C3' 111.045 -2.97 . 0.395 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.811 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.845 0 C5'-C4'-C3' 110.881 -3.079 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.687 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.428 0 O4'-C1'-N19 111.226 3.026 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.878 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.978 0 O4'-C1'-N19 111.223 3.023 . 0.045 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.715 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.129 0 O4'-C1'-N19 111.866 3.666 . 0.051 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.819 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.199 0 C5'-C4'-C3' 111.293 -2.805 . 0.055 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.663 ' C2 ' ' C5 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.595 0 C3'-C2'-C1' 105.032 3.924 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.681 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.148 0 O4'-C1'-N19 111.126 2.926 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.817 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.072 0 O4'-C1'-N19 111.121 2.921 . 0.063 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.817 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.512 0 C3'-C2'-C1' 104.984 3.871 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.671 " H5'" " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.059 0 O4'-C1'-N19 111.199 2.999 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 1.005 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.318 0 O4'-C1'-N19 111.362 3.162 . 0.052 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 1.005 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.284 0 O4'-C1'-N19 111.508 3.308 . 0.206 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.324 0 O4'-C1'-N19 111.298 3.098 . 0.066 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.212 0 N-CA-C 112.558 -0.217 . . . . 0.0 112.558 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 365' ' ' SER . . . . . 0.541 ' CB ' ' OP1' ' A' ' 15' ' ' ' A' . 24.9 p -102.7 31.79 3.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.794 0.331 . . . . 0.0 111.035 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 5.0 tp -60.4 -14.34 18.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.984 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.434 ' O ' ' HG2' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -41.59 -69.07 0.15 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.978 179.387 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.515 ' N ' ' HE3' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -36.09 -66.7 0.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.617 179.6 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -38.23 -48.87 1.33 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.5 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 1.118 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -60.38 -80.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.245 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.622 ' NZ ' ' H21' ' A' ' 19' ' ' ' G' . 0.0 OUTLIER -33.61 -40.44 0.07 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.99 0.424 . . . . 0.0 110.725 179.761 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.597 ' HG2' ' N3 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -57.13 -59.61 4.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.102 179.191 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.521 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.6 OUTLIER -47.62 -49.46 27.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.171 0.51 . . . . 0.0 111.215 179.615 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.537 HD13 ' OH ' ' B' ' 387' ' ' TYR . 0.9 OUTLIER -52.28 -70.51 0.09 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.263 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.557 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.5 m-85 -80.72 -48.33 12.7 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -177.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.526 ' CB ' ' HD2' ' B' ' 372' ' ' ARG . 8.2 t -59.88 -26.45 65.88 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 -178.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.802 ' O ' HD13 ' B' ' 378' ' ' ILE . 4.4 mm? -120.63 -25.24 5.56 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -178.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.802 HD13 ' O ' ' B' ' 377' ' ' LEU . 3.1 mm -133.23 35.91 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.557 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -140.97 82.73 0.23 Allowed Glycine 0 C--N 1.33 0.215 0 C-N-CA 120.084 -1.055 . . . . 0.0 113.344 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.561 ' CD2' ' HD3' ' B' ' 445' ' ' ARG . 15.7 p90 -99.39 24.34 8.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.103 0.477 . . . . 0.0 109.872 178.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.532 ' HB3' ' O ' ' B' ' 380' ' ' TYR . . . 80.04 -89.46 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.497 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.442 ' C ' ' O ' ' B' ' 381' ' ' ALA . 55.6 m -33.2 -38.53 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.3 -179.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.574 HD22 HG11 ' B' ' 406' ' ' VAL . 0.7 OUTLIER -41.49 -39.7 1.6 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.9 0.381 . . . . 0.0 110.968 -179.612 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.06 35.87 2.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.42 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.771 ' HA ' HG12 ' B' ' 406' ' ' VAL . 8.9 tt -75.03 123.86 25.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.547 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 24.6 p80 -147.9 147.35 29.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.539 0.685 . . . . 0.0 112.194 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.579 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 4.4 m-85 -92.47 155.43 17.85 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.935 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.36 125.19 53.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 4.3 m -88.72 131.53 34.99 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.597 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 1.061 HG23 HG23 ' B' ' 401' ' ' ILE . 16.3 m -137.16 158.27 35.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.324 0.583 . . . . 0.0 111.454 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.791 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.1 OUTLIER 79.54 64.38 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.361 179.626 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.421 ' HA ' ' HD2' ' B' ' 393' ' ' PRO . 0.4 OUTLIER -39.46 103.79 0.3 Allowed Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.642 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.477 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 1.8 Cg_endo -45.99 165.52 0.07 OUTLIER 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.81 2.34 . . . . 0.0 112.961 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 3.1 p -124.38 162.27 24.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.671 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -85.4 12.44 8.32 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.509 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 20.3 m -141.5 10.0 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.249 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.533 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 0.2 OUTLIER -174.32 51.04 0.1 OUTLIER Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.465 -179.796 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.533 ' CD ' ' N ' ' B' ' 397' ' ' ASP . 95.4 Cg_exo -31.21 -29.52 0.02 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 124.164 3.242 . . . . 0.0 114.105 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.532 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.5 p-10 -37.06 129.38 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.822 0.344 . . . . 0.0 111.0 -179.311 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 28.4 t -143.94 158.56 43.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.237 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 1.061 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -116.25 144.55 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-O 121.182 0.515 . . . . 0.0 111.771 -179.438 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.813 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.0 OUTLIER -127.11 128.67 70.71 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.603 179.951 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.503 ' CG ' ' OG1' ' B' ' 414' ' ' THR . 2.9 mt-10 -110.64 131.49 55.01 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.609 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.579 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 1.4 p -93.63 141.17 28.79 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.78 ' HA ' HD22 ' B' ' 412' ' ' LEU . 0.9 OUTLIER -162.16 -175.28 4.5 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.275 0.56 . . . . 0.0 112.345 -179.552 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.771 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -136.69 145.75 29.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.954 -179.622 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -34.89 -34.44 0.05 OUTLIER Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.654 -0.703 . . . . 0.0 113.742 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -60.82 -12.97 12.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.974 0.416 . . . . 0.0 110.726 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 91.03 36.3 6.75 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.722 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.554 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 18.5 m -118.65 116.46 26.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.538 0.209 . . . . 0.0 111.312 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.502 ' HA ' ' CB ' ' B' ' 405' ' ' ARG . 33.7 t -82.88 96.64 3.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.176 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.78 HD22 ' HA ' ' B' ' 405' ' ' ARG . 0.2 OUTLIER -50.89 -26.16 5.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.963 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.51 ' N ' ' SG ' ' B' ' 404' ' ' CYS . . . -177.44 -177.26 46.17 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 119.462 -1.351 . . . . 0.0 113.954 -179.595 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.791 ' CG2' HD11 ' B' ' 401' ' ' ILE . 6.3 m -148.56 120.08 7.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.28 -0.46 . . . . 0.0 110.469 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.585 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -130.48 163.77 23.11 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.419 -0.895 . . . . 0.0 113.152 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.467 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 3.2 p -135.33 161.06 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.763 -0.218 . . . . 0.0 110.416 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.819 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -155.87 115.61 0.67 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.043 -1.075 . . . . 0.0 113.424 -179.495 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.472 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -44.55 -54.82 5.67 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 122.189 0.196 . . . . 0.0 111.337 179.6 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.85 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.7 OUTLIER -86.98 -5.92 58.93 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.111 178.865 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.85 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.6 OUTLIER 94.46 -45.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 C-N-CA 123.65 0.78 . . . . 0.0 112.262 179.5 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -47.03 -60.56 2.37 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.616 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.819 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -42.26 -32.69 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.509 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.973 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.779 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -68.09 -45.95 72.34 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.146 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.509 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.54 -58.19 12.16 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 119.81 -1.186 . . . . 0.0 111.519 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.691 ' N ' HD13 ' B' ' 425' ' ' ILE . 1.9 mm -59.57 -36.28 64.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.768 0.318 . . . . 0.0 110.744 179.415 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.4 OUTLIER -62.15 -56.03 22.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.063 179.489 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.813 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -45.02 -42.3 8.24 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.017 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 1.118 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -53.62 -66.17 0.44 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.004 178.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.513 ' O ' ' N ' ' B' ' 433' ' ' ARG . 1.1 mt-10 -47.27 -44.37 22.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.687 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.441 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 0.7 OUTLIER -55.87 -29.49 60.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.909 179.685 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.452 ' HB3' HD22 ' B' ' 374' ' ' LEU . . . -72.3 -48.45 42.12 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 120.826 0.346 . . . . 0.0 110.421 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.847 ' H ' HD13 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -97.05 13.36 29.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.818 179.437 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -87.07 7.24 28.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.982 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.571 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 2.0 m-20 -117.65 74.65 0.94 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.918 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.435 ' C ' ' O ' ' B' ' 434' ' ' ASP . 14.3 ptmt -36.84 -43.85 0.46 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.499 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.432 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.1 OUTLIER -64.36 -47.92 77.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.397 179.768 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.629 ' SD ' HD12 ' B' ' 412' ' ' LEU . 2.0 ttp -60.79 -51.46 69.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.416 179.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.681 HD11 ' HB2' ' B' ' 432' ' ' LEU . 60.0 mt -58.0 -57.78 11.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.592 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -53.02 -30.42 35.28 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.914 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.466 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.6 OUTLIER -66.38 -40.85 89.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.501 179.191 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.572 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 42.9 m-85 -75.12 -49.49 19.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.812 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -41.48 -46.32 3.44 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -38.88 81.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.355 178.387 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.572 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -60.08 -26.78 66.44 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.119 179.122 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.566 ' O ' ' CG1' ' B' ' 448' ' ' ILE . 1.4 mmm180 -77.73 -45.89 23.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.563 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -55.76 -39.23 70.9 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.163 0.506 . . . . 0.0 109.793 179.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.513 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -73.97 -91.33 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.256 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.566 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 0.8 OUTLIER 18.04 91.73 0.04 OUTLIER Pre-proline 0 N--CA 1.466 0.328 0 O-C-N 123.735 0.647 . . . . 0.0 111.966 -179.679 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -40.3 -37.94 2.11 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 122.949 2.432 . . . . 0.0 112.681 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 450' ' ' ARG . . . . . 0.413 ' C ' ' OG ' ' B' ' 451' ' ' SER . 0.0 OUTLIER -41.73 141.23 0.83 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.915 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 451' ' ' SER . . . . . 0.413 ' OG ' ' C ' ' B' ' 450' ' ' ARG . 0.0 OUTLIER 67.74 67.77 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.994 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -174.86 167.21 3.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.814 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.902 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.818 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.849 0 C3'-C2'-C1' 104.398 3.22 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.818 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.128 0 O4'-C1'-N19 111.13 2.93 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.499 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.791 0 C3'-C2'-C1' 104.88 3.756 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.542 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.268 0 O4'-C1'-N19 111.244 3.044 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.542 ' C6 ' " H2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.298 0 O4'-C1'-N19 111.259 3.059 . 0.326 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.637 " O2'" " H5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.178 0 C5'-C4'-C3' 111.116 -2.922 . 0.162 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.731 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.435 1.789 0 O4'-C1'-N19 111.444 3.244 . 0.23 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.468 " H2'" " O4'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.244 0 O4'-C1'-N19 111.138 2.938 . 0.132 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.468 " O4'" " H2'" ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.373 0 O4'-C1'-N19 111.19 2.99 . 0.07 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.5 " O2'" " O5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.575 0 O4'-C1'-N19 111.186 2.986 . 0.204 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.547 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.599 0 O4'-C1'-N19 110.983 2.783 . 0.047 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.751 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.938 0 O4'-C1'-N19 111.329 3.129 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.751 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.313 0 C3'-C2'-C1' 104.518 3.353 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.654 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.054 0 C5'-C4'-C3' 111.108 -2.928 . 0.034 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.93 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.422 0 C5'-C4'-C3' 111.035 -2.976 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.93 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.929 0 C5'-C4'-C3' 110.88 -3.08 . 0.157 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.448 " H2'" ' N9 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.201 0 C5'-C4'-C3' 110.925 -3.05 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.655 ' H61' " C2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.824 0 O4'-C1'-N19 111.012 2.812 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.514 " H2'" ' C8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.827 0 C5'-C4'-C3' 110.859 -3.094 . 0.099 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.649 " O2'" " C5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.9 0 C5'-C4'-C3' 110.709 -3.194 OUTLIER-DELTA 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.649 " C5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.613 2.026 0 O4'-C1'-N19 111.273 3.073 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.855 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.613 2.04 0 O4'-C1'-N19 111.318 3.118 . 0.019 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.788 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.258 0 O4'-C1'-N19 111.058 2.858 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.626 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.684 0 C3'-C2'-C1' 104.848 3.72 . 0.016 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.6 " O5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.443 2.434 0 O4'-C1'-N19 111.147 2.947 . 0.064 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.563 " O2'" " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.776 0 C5'-C4'-C3' 111.118 -2.922 . 0.092 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.757 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.145 0 O4'-C1'-N19 111.253 3.053 . 0.169 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.757 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.687 0 C3'-C2'-C1' 104.787 3.652 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.796 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.161 0 O4'-C1'-N19 111.315 3.115 . 0.111 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 1.021 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.353 0 O4'-C1'-N19 111.606 3.406 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 1.021 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.507 0 O4'-C1'-N19 111.277 3.077 . 0.178 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.515 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.373 0 O4'-C1'-N19 111.228 3.028 . 0.43 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.093 0 N-CA-C 112.342 -0.303 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 31.6 m 55.31 46.16 24.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.722 0.296 . . . . 0.0 110.836 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.444 ' HB3' ' HB2' ' B' ' 369' ' ' ASN . 0.3 OUTLIER -139.38 126.55 21.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.307 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.478 ' HB2' ' NZ ' ' B' ' 371' ' ' LYS . 0.6 OUTLIER -52.9 -68.03 0.2 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.667 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.503 ' HA ' ' CD ' ' B' ' 371' ' ' LYS . 4.2 tmm? -39.58 -46.36 1.76 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.666 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.444 ' HB2' ' HB3' ' B' ' 366' ' ' LEU . 4.5 m-20 -56.45 -52.75 63.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.411 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.895 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -50.9 -69.78 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.022 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.513 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 5.1 mttp -31.36 -53.71 0.23 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.124 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.535 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.7 ttt-85 -51.59 -45.92 63.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.553 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.604 ' NE2' ' HG ' ' B' ' 377' ' ' LEU . 1.6 tm0? -57.14 -47.02 82.18 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.173 0.511 . . . . 0.0 110.737 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.608 ' N ' HD23 ' B' ' 374' ' ' LEU . 3.6 mt -53.91 -68.57 0.17 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -179.055 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.602 ' CE2' ' OP1' ' A' ' 20' ' ' ' A' . 3.6 m-30 -85.73 -42.21 14.44 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -177.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.7 OUTLIER -67.84 -27.94 67.13 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.218 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.684 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.3 OUTLIER -106.32 -31.34 8.66 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.773 0.32 . . . . 0.0 110.765 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.748 HG22 HD22 ' B' ' 383' ' ' LEU . 1.3 mm -137.24 -148.08 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.529 ' H ' HG22 ' B' ' 378' ' ' ILE . . . 28.73 72.83 0.04 OUTLIER Glycine 0 C--N 1.332 0.359 0 C-N-CA 121.23 -0.509 . . . . 0.0 113.45 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.637 ' CE1' HD13 ' B' ' 383' ' ' LEU . 10.4 p90 -89.93 -55.41 3.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.662 0.268 . . . . 0.0 111.116 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -176.69 -48.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.817 0.342 . . . . 0.0 111.366 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.48 16.65 4.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.124 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.748 HD22 HG22 ' B' ' 378' ' ' ILE . 2.9 tp -103.21 -27.77 12.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.028 0.442 . . . . 0.0 110.807 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 8.0 tpp85 62.32 15.71 7.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.971 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.681 ' HA ' HG12 ' B' ' 406' ' ' VAL . 6.5 tt -48.02 128.74 14.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.702 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -158.59 136.95 10.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.304 0.573 . . . . 0.0 112.25 -179.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.582 ' CZ ' ' HB3' ' B' ' 404' ' ' CYS . 6.9 m-85 -87.86 162.93 16.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.578 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.591 HG23 ' O ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -138.35 147.58 25.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.97 178.498 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 389' ' ' THR . . . . . 0.446 HG22 ' O ' ' B' ' 389' ' ' THR . 1.0 OUTLIER -112.12 109.94 19.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 0.0 110.668 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.956 HG23 HG23 ' B' ' 401' ' ' ILE . 29.7 m -112.51 155.13 13.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.559 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.634 ' HB3' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 67.68 69.38 0.35 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.413 -179.665 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.424 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 17.0 mmtt -54.56 149.27 21.88 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.097 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.539 ' HB2' " O2'" ' A' ' 5' ' ' ' U' . 11.2 Cg_exo -72.55 165.06 33.8 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 123.081 2.521 . . . . 0.0 112.526 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.471 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 1.2 p -156.47 165.84 35.14 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.498 179.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -79.37 4.78 14.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.846 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 396' ' ' VAL . . . . . 0.582 HG23 ' OD2' ' B' ' 397' ' ' ASP . 6.1 m -130.99 17.06 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.292 0.568 . . . . 0.0 109.558 178.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.582 ' OD2' HG23 ' B' ' 396' ' ' VAL . 2.8 p30 166.02 60.42 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.967 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.511 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 96.3 Cg_exo -39.4 -54.72 1.76 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.045 2.497 . . . . 0.0 112.934 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.494 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 18.3 p30 -21.65 137.01 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.402 -178.558 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -143.69 141.53 30.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.973 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.956 HG23 HG23 ' B' ' 390' ' ' VAL . 0.1 OUTLIER -111.16 139.0 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 CA-C-O 121.465 0.65 . . . . 0.0 111.776 -179.055 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.781 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -102.27 176.65 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.055 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.591 ' O ' HG23 ' B' ' 388' ' ' VAL . 4.9 mt-10 -156.2 106.98 2.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.984 0.421 . . . . 0.0 110.833 179.297 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.582 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -88.64 128.45 35.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.482 ' HA ' ' O ' ' B' ' 410' ' ' THR . 12.5 ptt180 -155.19 173.09 17.11 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.642 -179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.681 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -132.81 132.59 59.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.87 -179.249 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 407' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' B' ' 406' ' ' VAL . . . -30.95 -32.14 0.01 OUTLIER Glycine 0 C--N 1.333 0.407 0 O-C-N 123.436 0.46 . . . . 0.0 113.555 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 408' ' ' ASP . . . . . 0.545 ' N ' ' O ' ' B' ' 406' ' ' VAL . 21.4 t0 -57.17 -16.42 7.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.014 0.435 . . . . 0.0 110.387 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 409' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 95.72 35.86 5.49 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.785 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.482 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 16.9 m -128.28 124.79 37.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.082 0.468 . . . . 0.0 111.737 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.489 HG13 ' O ' ' B' ' 404' ' ' CYS . 47.9 t -89.2 89.43 3.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.525 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.643 HD12 ' CE ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -46.01 -26.44 0.73 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.897 0.38 . . . . 0.0 110.23 -179.928 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.46 ' O ' HG12 ' B' ' 411' ' ' VAL . . . 177.61 -173.77 46.37 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.858 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.467 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 3.4 t -160.64 171.37 19.03 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.667 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -173.01 170.41 43.56 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 118.525 -1.798 . . . . 0.0 114.836 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.526 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 5.2 p -136.76 152.05 28.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.321 -0.439 . . . . 0.0 110.209 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.809 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -153.66 111.54 0.49 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.904 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -42.05 -56.77 2.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.739 0.304 . . . . 0.0 110.923 179.706 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.893 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.1 OUTLIER -82.7 -11.27 58.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.248 179.151 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.893 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 97.12 -44.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.249 0 C-N-CA 123.873 0.869 . . . . 0.0 111.903 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.526 ' HE3' " O3'" ' A' ' 22' ' ' ' C' . 0.5 OUTLIER -48.08 -59.31 3.48 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.534 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.809 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -41.86 -31.42 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 177.845 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.793 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -71.65 -45.33 62.34 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.687 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.11 -59.9 9.27 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 119.906 -1.14 . . . . 0.0 111.702 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.736 ' N ' HD13 ' B' ' 425' ' ' ILE . 1.2 mm -57.84 -51.23 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.89 0.376 . . . . 0.0 110.797 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.567 ' HG2' ' HA3' ' B' ' 415' ' ' GLY . 0.0 OUTLIER -46.37 -51.17 15.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.237 179.687 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.588 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -51.1 -54.15 27.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.807 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.895 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -51.94 -65.5 0.55 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.253 0.549 . . . . 0.0 110.639 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.664 ' HA ' HD21 ' B' ' 432' ' ' LEU . 55.9 mt-10 -52.87 -19.52 2.61 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.443 179.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.485 ' ND2' ' HG3' ' B' ' 426' ' ' ARG . 0.8 OUTLIER -77.97 -32.47 51.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.34 -179.795 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.3 -42.53 44.96 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.345 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.964 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -87.33 14.48 7.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.759 179.807 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.495 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 8.2 ttt85 -88.01 4.65 44.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.67 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.564 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 12.7 m-20 -116.07 72.37 0.81 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.074 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' B' ' 436' ' ' LYS . 15.2 ptpt -41.69 -47.33 3.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.686 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.518 ' N ' ' HG3' ' B' ' 435' ' ' LYS . 1.7 mmmm -58.4 -47.63 83.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.146 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.643 ' CE ' HD12 ' B' ' 412' ' ' LEU . 13.2 tmm? -65.79 -54.7 23.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.012 0.434 . . . . 0.0 109.864 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.964 HD11 ' HA ' ' B' ' 432' ' ' LEU . 99.2 mt -51.61 -68.07 0.2 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.221 179.098 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -44.41 -36.2 2.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.859 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.633 ' CE2' ' CE1' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -60.98 -41.91 97.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.26 0.552 . . . . 0.0 109.639 179.692 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.633 ' CE1' ' CE2' ' B' ' 440' ' ' PHE . 40.9 m-85 -75.54 -33.7 60.7 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.545 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.81 -46.1 64.14 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.93 -45.62 77.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.479 178.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.886 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -57.99 -25.92 61.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.306 179.376 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.577 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -88.9 -24.38 22.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.434 -179.283 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -80.64 -41.16 24.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.929 0.395 . . . . 0.0 110.471 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.437 ' O ' ' N ' ' B' ' 449' ' ' PRO . . . -68.94 -50.55 48.33 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.188 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.886 HG23 ' O ' ' B' ' 444' ' ' GLN . 3.8 pt -30.53 92.92 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.874 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 449' ' ' PRO . . . . . 0.437 ' N ' ' O ' ' B' ' 447' ' ' ALA . 72.5 Cg_exo -48.08 -37.28 30.16 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.798 2.332 . . . . 0.0 111.881 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 50.46 -159.38 0.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.973 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 52.12 89.68 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.944 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -98.46 -49.9 4.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.86 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 8.5 t . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.921 179.967 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.792 HO2' ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.846 0 C3'-C2'-C1' 104.458 3.287 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.792 ' H8 ' HO2' ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 1.959 0 O4'-C1'-N19 111.294 3.094 . 0.03 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.712 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.357 0 O4'-C1'-N19 111.017 2.817 . 0.244 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.492 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.206 0 C5'-C4'-C3' 111.227 -2.849 . 0.036 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.515 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.104 0 O4'-C1'-N19 111.462 3.262 . 0.254 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.499 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.281 0 O4'-C1'-N19 111.168 2.968 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.793 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.98 0 O4'-C1'-N19 111.291 3.091 . 0.154 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.682 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.195 0 O4'-C1'-N19 111.12 2.92 . 0.235 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.682 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.31 0 O4'-C1'-N19 110.986 2.786 . 0.1 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.85 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.873 0 C5'-C4'-C3' 111.045 -2.97 . 0.094 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.64 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.464 0 O4'-C1'-N19 111.343 3.143 . 0.061 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.717 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.942 0 C5'-C4'-C3' 111.111 -2.926 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.717 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.345 0 C3'-C2'-C1' 104.468 3.298 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.765 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.284 0 C5'-C4'-C3' 111.111 -2.926 . 0.247 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.872 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.435 1.78 0 C5'-C4'-C3' 110.898 -3.068 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.872 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.381 0 O4'-C1'-N19 111.418 3.218 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.687 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.143 0 O4'-C1'-N19 111.255 3.055 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.747 " O5'" ' H8 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.727 0 C5'-C4'-C3' 110.888 -3.075 OUTLIER-DELTA 0.0 OUTLIER '7D dist 2a' 0.0 . . . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.622 ' H21' ' CE ' ' B' ' 371' ' ' LYS . . . . . . . . 0 O4'--C1' 1.439 2.091 0 O4'-C1'-N19 111.162 2.962 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.916 " H2'" " O4'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.434 1.693 0 C5'-C4'-C3' 110.984 -3.011 . 0.219 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.916 " O4'" " H2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.386 0 C3'-C2'-C1' 104.448 3.276 . 0.029 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.849 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.873 0 O4'-C1'-N19 111.217 3.017 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.632 " O2'" " C5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.172 0 O4'-C1'-N19 111.77 3.57 . 0.029 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.87 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.181 0 C5'-C4'-C3' 111.43 -2.713 . 0.056 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.506 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.288 0 O4'-C1'-N19 111.23 3.03 . 0.562 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.606 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.518 0 C5'-C4'-C3' 111.19 -2.873 . 0.078 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.79 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.036 0 O4'-C1'-N19 111.153 2.953 . 0.159 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.79 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.614 0 C3'-C2'-C1' 104.955 3.839 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.711 ' H6 ' " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.194 0 O4'-C1'-N19 111.319 3.119 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 1.001 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.327 0 O4'-C1'-N19 111.628 3.428 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 1.001 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.787 0 C3'-C2'-C1' 104.566 3.406 . 0.059 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.556 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.862 0 C3'-C2'-C1' 104.21 3.011 . 0.297 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.636 -0.186 . . . . 0.0 112.636 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 365' ' ' SER . . . . . 0.481 ' O ' ' HB2' ' B' ' 366' ' ' LEU . 1.6 t -88.09 17.13 5.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.977 0.418 . . . . 0.0 110.708 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.495 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 0.1 OUTLIER 83.49 -35.15 0.07 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.738 179.709 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.472 ' OD1' ' N ' ' B' ' 367' ' ' ASP . 0.5 OUTLIER -42.91 -78.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.774 0.321 . . . . 0.0 110.4 179.867 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.545 ' HA ' ' CG ' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -37.49 -44.75 0.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.54 -179.846 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.498 ' O ' ' HB2' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -52.1 -57.97 7.96 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.057 0.456 . . . . 0.0 110.337 178.912 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.941 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -57.66 -72.51 0.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.622 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.622 ' CE ' ' H21' ' A' ' 19' ' ' ' G' . 0.0 OUTLIER -36.04 -31.92 0.03 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.977 0.418 . . . . 0.0 110.21 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.631 ' CG ' ' N3 ' ' A' ' 18' ' ' ' A' . 0.1 OUTLIER -65.42 -54.02 34.7 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.56 178.894 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.709 ' HG2' HD22 ' B' ' 377' ' ' LEU . 0.0 OUTLIER -53.73 -37.89 63.8 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.367 0.603 . . . . 0.0 110.328 179.017 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.543 ' N ' HD23 ' B' ' 374' ' ' LEU . 2.9 mt -64.56 -79.37 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -178.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.407 ' CD2' " H5'" ' A' ' 20' ' ' ' A' . 3.4 m-30 -85.47 12.42 8.49 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.581 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -127.2 -15.38 5.24 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.686 -0.406 . . . . 0.0 111.741 179.805 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 1.053 ' O ' HD13 ' B' ' 378' ' ' ILE . 9.0 mp -124.98 -21.77 4.62 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.808 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 1.053 HD13 ' O ' ' B' ' 377' ' ' LEU . 12.1 mm -137.41 -72.39 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.619 ' HA2' HD13 ' B' ' 383' ' ' LEU . . . -47.14 79.45 0.0 OUTLIER Glycine 0 CA--C 1.52 0.37 0 CA-C-N 116.201 -0.454 . . . . 0.0 113.807 -179.149 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.591 ' CD2' HD12 ' B' ' 383' ' ' LEU . 45.3 p90 -76.9 -161.07 0.18 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.649 0.261 . . . . 0.0 111.058 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.553 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -84.7 105.73 15.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.693 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.553 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.1 t 91.22 47.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.719 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.78 HD23 ' O ' ' B' ' 383' ' ' LEU . 4.5 tt -101.93 -23.21 14.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.889 0.376 . . . . 0.0 110.276 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.493 ' O ' ' ND1' ' B' ' 386' ' ' HIS . 13.7 tpt180 81.28 5.0 1.4 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.354 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.603 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 6.1 tt -57.13 135.23 56.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.945 0.403 . . . . 0.0 110.376 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.529 ' N ' HD23 ' B' ' 385' ' ' LEU . 18.3 p-80 -167.05 147.41 5.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.405 0.621 . . . . 0.0 112.375 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.531 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 4.1 m-85 -98.85 138.66 35.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.385 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.515 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -118.01 118.77 59.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.298 0.57 . . . . 0.0 110.629 179.272 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 53.9 m -78.64 129.19 34.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.982 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 1.003 HG23 HG23 ' B' ' 401' ' ' ILE . 27.3 m -136.71 154.29 31.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.666 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.707 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 84.88 49.27 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.354 -179.539 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.444 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER -29.76 109.44 0.25 Allowed Pre-proline 0 N--CA 1.462 0.144 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.33 -179.433 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.459 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 1.9 Cg_endo -48.01 158.54 0.84 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 122.816 2.344 . . . . 0.0 113.422 -179.172 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.509 ' HG1' ' CG ' ' B' ' 397' ' ' ASP . 40.2 p -124.69 165.01 18.69 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.729 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 395' ' ' ALA . . . . . 0.556 ' HB1' " H1'" ' A' ' 30' ' ' ' C' . . . -88.63 15.8 7.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.802 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 396' ' ' VAL . . . . . 0.574 ' CG2' ' O ' ' B' ' 396' ' ' VAL . 0.2 OUTLIER -141.6 9.56 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.937 0.875 . . . . 0.0 109.909 179.51 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.509 ' CG ' ' HG1' ' B' ' 394' ' ' THR . 3.5 p-10 171.22 59.12 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.543 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.481 ' O ' ' C ' ' B' ' 399' ' ' ASN . 5.2 Cg_exo -39.34 -31.55 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 123.611 2.874 . . . . 0.0 112.412 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.511 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 13.9 m120 -25.38 109.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.568 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 400' ' ' SER . . . . . 0.409 ' O ' HG23 ' B' ' 416' ' ' VAL . 12.9 m -127.92 162.53 26.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.605 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 1.003 HG23 HG23 ' B' ' 390' ' ' VAL . 0.6 OUTLIER -119.78 151.01 22.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.517 -179.882 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.726 ' CG2' ' HB1' ' B' ' 423' ' ' ALA . 0.1 OUTLIER -120.27 154.3 23.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.515 ' CB ' HG23 ' B' ' 388' ' ' VAL . 13.6 mm-40 -122.81 130.15 52.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.809 0.338 . . . . 0.0 110.685 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.532 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.5 OUTLIER -112.43 112.67 24.39 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.842 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.52 ' CG ' ' N ' ' B' ' 406' ' ' VAL . 0.1 OUTLIER -138.64 -166.33 1.99 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 121.349 0.595 . . . . 0.0 111.888 -178.823 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.753 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -157.79 140.4 6.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.328 -179.354 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 407' ' ' GLY . . . . . 0.46 ' HA2' ' HG2' ' B' ' 384' ' ' ARG . . . 64.78 6.73 25.24 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.551 -0.833 . . . . 0.0 111.322 -178.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 20.6 t70 72.41 35.45 1.17 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.685 0.279 . . . . 0.0 111.11 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -155.73 -49.46 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.497 -0.858 . . . . 0.0 113.22 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.753 ' HB ' HG23 ' B' ' 406' ' ' VAL . 53.4 m -82.12 105.65 13.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.681 0.277 . . . . 0.0 111.68 -179.4 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.408 ' CG1' ' OE1' ' B' ' 403' ' ' GLU . 79.1 t -90.06 111.07 22.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.651 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.889 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -64.65 -35.23 80.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.313 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.462 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 175.76 -148.68 9.5 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.561 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.501 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 8.7 t -168.53 166.84 11.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.776 0.322 . . . . 0.0 111.301 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.576 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -154.8 136.87 5.38 Favored Glycine 0 C--O 1.228 -0.259 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.679 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.535 ' HB ' HD12 ' B' ' 401' ' ' ILE . 8.4 p -122.69 149.19 26.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.893 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -163.63 151.88 21.57 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.135 -1.031 . . . . 0.0 113.24 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.481 ' HG3' ' OD1' ' B' ' 419' ' ' ASN . 0.6 OUTLIER -62.83 -45.45 92.56 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.359 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.842 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.5 OUTLIER -100.02 32.19 3.03 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.892 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.668 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 47.42 -44.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 178.499 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.623 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -47.88 -45.46 30.45 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 119.12 0.873 . . . . 0.0 108.93 -179.219 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.893 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -49.95 -40.55 16.68 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.785 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 177.873 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.726 ' HB1' ' CG2' ' B' ' 402' ' ' VAL . . . -62.2 -46.04 90.66 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.492 178.347 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.49 -70.03 1.13 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.404 -0.903 . . . . 0.0 111.604 178.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.471 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 0.5 OUTLIER -50.92 -33.47 12.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.315 179.284 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.586 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 1.5 tpt180 -63.76 -57.89 8.56 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.513 179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.616 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -42.97 -39.59 2.66 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.238 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.941 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -60.29 -60.46 3.78 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.219 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.542 ' O ' HD22 ' B' ' 432' ' ' LEU . 32.2 mt-10 -47.66 -21.28 0.35 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.281 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.501 ' ND2' ' O ' ' B' ' 414' ' ' THR . 1.7 m-80 -81.57 -36.48 29.01 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.741 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.455 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -63.62 -38.38 90.91 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.161 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.685 HD13 ' O ' ' B' ' 428' ' ' ALA . 0.0 OUTLIER -94.08 11.68 29.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.991 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 0.9 OUTLIER -92.8 4.62 53.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.142 -179.79 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.544 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 15.6 m-20 -119.31 92.14 3.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 0.0 110.85 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.438 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -56.38 -46.43 80.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.476 -179.635 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.438 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -60.61 -42.14 96.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.943 0.401 . . . . 0.0 110.548 -179.8 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.889 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -71.37 -46.49 60.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.164 179.442 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.55 HD11 ' HA ' ' B' ' 432' ' ' LEU . 54.5 mt -56.12 -65.41 0.61 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.115 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -51.16 -36.48 41.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.97 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.466 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.9 OUTLIER -53.55 -44.42 69.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.67 179.642 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.788 ' CB ' HG23 ' B' ' 378' ' ' ILE . 43.0 m-85 -65.16 -49.47 69.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.539 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.412 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -39.24 -51.19 1.99 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -38.81 92.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.979 178.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.771 ' O ' HG23 ' B' ' 448' ' ' ILE . 9.0 mt-30 -64.6 -36.76 85.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.044 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.523 ' O ' ' CG1' ' B' ' 448' ' ' ILE . 0.0 OUTLIER -62.66 -51.82 65.73 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.57 179.894 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -63.84 -36.13 82.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.091 0.472 . . . . 0.0 110.519 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.467 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -67.44 -69.45 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.177 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.771 HG23 ' O ' ' B' ' 444' ' ' GLN . 2.9 pt -28.4 138.6 0.11 Allowed Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.843 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 449' ' ' PRO . . . . . 0.454 ' O ' ' O ' ' B' ' 448' ' ' ILE . 73.2 Cg_exo -43.26 177.02 0.0 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.265 0 C-N-CA 123.193 2.595 . . . . 0.0 112.548 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 450' ' ' ARG . . . . . 0.422 ' O ' ' O ' ' B' ' 451' ' ' SER . 0.1 OUTLIER 50.97 -176.12 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.915 179.902 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 451' ' ' SER . . . . . 0.483 ' O ' ' N ' ' B' ' 453' ' ' SER . 0.3 OUTLIER 55.72 158.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.029 179.956 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 63.5 -69.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.732 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 453' ' ' SER . . . . . 0.483 ' N ' ' O ' ' B' ' 451' ' ' SER . 0.7 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.168 -0.92 . . . . 0.0 110.768 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.737 HO2' ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.644 0 C3'-C2'-C1' 104.411 3.235 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.811 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.443 2.376 0 O4'-C1'-N19 111.213 3.013 . 0.129 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.811 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.379 0 O4'-C1'-N19 111.087 2.887 . 0.097 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.516 " O2'" " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.324 0 O4'-C1'-N19 111.324 3.124 . 0.147 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.516 " C4'" ' HB3' ' B' ' 398' ' ' PRO . . . . . . . . 0 O4'--C1' 1.439 2.103 0 O4'-C1'-N19 111.193 2.993 . 0.103 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.468 " H5'" " O2'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.664 0 C3'-C2'-C1' 104.249 3.055 . 0.021 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.478 " H2'" ' C6 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.005 0 O4'-C1'-N19 111.534 3.334 . 0.157 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.619 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.237 0 O4'-C1'-N19 111.165 2.965 . 0.192 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.619 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.443 0 O4'-C1'-N19 111.128 2.928 . 0.068 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.816 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.853 0 O4'-C1'-N19 111.21 3.01 . 0.091 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.64 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.378 0 O4'-C1'-N19 111.206 3.006 . 0.056 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.711 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.848 0 O4'-C1'-N19 111.138 2.938 . 0.03 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.711 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.328 0 C3'-C2'-C1' 104.384 3.205 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.636 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.28 0 C5'-C4'-C3' 111.234 -2.844 . 0.071 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.874 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.428 -2.105 0 C5'-C4'-C3' 110.824 -3.117 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.874 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.147 0 O4'-C1'-N19 111.284 3.084 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.592 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.432 -1.717 0 C5'-C4'-C3' 110.885 -3.077 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.665 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.888 0 C5'-C4'-C3' 111.067 -2.955 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.555 " O4'" " O2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.392 0 C5'-C4'-C3' 111.267 -2.822 . 0.352 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.816 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.913 0 C5'-C4'-C3' 110.95 -3.033 . 0.198 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.816 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.471 0 C5'-C4'-C3' 110.941 -3.039 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.817 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.117 0 C5'-C4'-C3' 111.224 -2.851 . 0.146 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.806 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.336 0 O4'-C1'-N19 111.673 3.473 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.724 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.171 0 O4'-C1'-N19 110.917 2.717 . 0.101 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.505 " H5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.362 0 O4'-C1'-N19 111.237 3.037 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.585 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.511 0 C5'-C4'-C3' 111.003 -2.998 . 0.072 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.974 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.086 0 O4'-C1'-N19 111.069 2.869 . 0.321 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.974 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.336 0 O4'-C1'-N19 111.227 3.027 . 0.173 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.874 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.267 0 O4'-C1'-N19 110.962 2.762 . 0.204 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.975 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.338 0 O4'-C1'-N19 111.241 3.041 . 0.246 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.975 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.721 0 O4'-C1'-N19 111.313 3.113 . 0.152 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.431 ' C6 ' " H2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.305 0 C5'-C4'-C3' 111.262 -2.826 . 0.465 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.459 -0.257 . . . . 0.0 112.459 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 32.4 m -134.16 76.68 1.66 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.641 0.258 . . . . 0.0 110.97 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.554 HD23 ' H ' ' B' ' 366' ' ' LEU . 0.1 OUTLIER -65.91 176.35 1.66 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.96 0.409 . . . . 0.0 110.942 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.519 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.2 OUTLIER -47.63 -69.55 0.12 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.936 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.511 ' SD ' " O2'" ' A' ' 15' ' ' ' A' . 1.7 ttp -36.17 -43.0 0.33 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.509 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -64.27 -43.27 95.34 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.85 0.357 . . . . 0.0 110.681 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.979 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -65.75 -74.87 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.438 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.549 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -33.92 -46.18 0.22 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.104 0.478 . . . . 0.0 110.571 179.826 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.581 ' HD2' ' N3 ' ' A' ' 18' ' ' ' A' . 9.5 ttp85 -60.44 -45.85 92.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.004 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.2 OUTLIER -60.17 -53.15 61.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.0 -179.244 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.714 ' N ' HD23 ' B' ' 374' ' ' LEU . 0.3 OUTLIER -56.74 -64.13 0.97 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -178.448 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.538 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.3 m-85 -78.26 -52.09 9.17 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -177.478 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.508 ' OG ' " O2'" ' A' ' 18' ' ' ' A' . 1.3 t -69.05 -29.15 67.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.877 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.9 OUTLIER -102.89 -35.53 8.56 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.665 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.877 HD13 ' O ' ' B' ' 377' ' ' LEU . 8.1 mm -136.01 37.44 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.538 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -121.61 81.13 0.34 Allowed Glycine 0 CA--C 1.517 0.207 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.8 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 1.1 ' CE2' HD12 ' B' ' 383' ' ' LEU . 36.1 p90 -105.11 174.37 5.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.887 0.375 . . . . 0.0 110.812 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -80.07 82.17 6.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.15 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.508 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 0.6 OUTLIER 160.71 -31.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.162 179.792 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 1.1 HD12 ' CE2' ' B' ' 380' ' ' TYR . 0.2 OUTLIER -54.21 -54.97 32.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.925 0.393 . . . . 0.0 110.468 179.784 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' B' ' 385' ' ' LEU . 5.4 tpt180 76.28 46.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.414 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.845 ' HA ' HG12 ' B' ' 406' ' ' VAL . 3.0 mt -38.82 140.22 0.38 Allowed 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -140.8 89.27 2.25 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -177.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.683 ' HE1' HD22 ' B' ' 385' ' ' LEU . 39.7 m-85 -91.87 122.76 34.7 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 177.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -114.83 118.16 57.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.396 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 8.4 m -83.81 110.16 18.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.657 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.811 HG23 HG23 ' B' ' 401' ' ' ILE . 35.9 m -115.92 149.93 18.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.16 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.657 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 88.68 58.54 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.077 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.448 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 0.0 OUTLIER -38.13 142.89 0.44 Allowed Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.507 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' B' ' 392' ' ' LYS . 7.0 Cg_exo -71.37 158.76 53.5 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.181 1.921 . . . . 0.0 113.019 -178.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.455 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 34.8 p -129.62 161.02 31.51 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.355 -179.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -85.32 14.26 5.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.563 179.319 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 4.7 m -136.89 9.26 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.886 178.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.402 ' CG ' ' OD1' ' B' ' 399' ' ' ASN . 0.2 OUTLIER 168.7 62.94 0.01 OUTLIER Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.785 -179.483 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.516 ' HB3' " C4'" ' A' ' 5' ' ' ' U' . 1.6 Cg_endo -42.08 -35.71 3.44 Favored 'Trans proline' 0 N--CA 1.464 -0.225 0 C-N-CA 123.687 2.925 . . . . 0.0 112.572 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.539 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.2 p-10 -29.01 121.12 0.13 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.041 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 1.3 t -131.42 162.5 30.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.053 179.521 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.811 HG23 HG23 ' B' ' 390' ' ' VAL . 0.0 OUTLIER -120.42 155.87 23.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.963 0.411 . . . . 0.0 111.501 -179.423 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.757 ' N ' HD13 ' B' ' 401' ' ' ILE . 0.1 OUTLIER -126.45 139.73 50.84 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.831 -179.591 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 403' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -102.26 119.86 39.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.939 0.399 . . . . 0.0 110.476 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.658 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 5.6 t -92.22 95.35 9.67 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.513 ' HA ' ' O ' ' B' ' 410' ' ' THR . 35.3 ttp180 -129.16 162.27 28.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.461 -178.447 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.845 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -139.64 144.56 28.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.074 -179.657 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 55.97 14.0 7.36 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.298 -0.953 . . . . 0.0 111.296 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 13.1 t70 57.51 23.01 8.67 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 120.801 0.334 . . . . 0.0 110.288 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -139.96 -0.71 1.92 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.238 -0.982 . . . . 0.0 113.703 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.675 ' HB ' HG23 ' B' ' 406' ' ' VAL . 23.3 m -142.83 117.59 9.87 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 117.237 0.518 . . . . 0.0 111.759 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.484 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 73.4 t -95.55 108.51 21.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.589 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.794 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -63.06 -37.2 86.24 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.85 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 175.21 -139.93 5.01 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.213 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.684 ' OG1' HD11 ' B' ' 401' ' ' ILE . 3.0 t -170.12 168.48 8.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.684 0.278 . . . . 0.0 110.854 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.648 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -159.99 131.84 2.8 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.497 -0.858 . . . . 0.0 112.424 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.463 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 7.7 p -119.15 146.05 24.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.873 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -154.53 144.37 11.08 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.057 -1.068 . . . . 0.0 112.992 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.452 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 5.5 ptm180 -57.01 -45.87 82.73 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.846 0.355 . . . . 0.0 111.69 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.808 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -99.34 29.41 3.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.274 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.767 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.5 OUTLIER 50.74 -45.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 179.133 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.629 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -45.24 -56.73 4.55 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 118.884 0.765 . . . . 0.0 109.247 179.884 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.873 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -42.01 -33.77 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 177.882 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.767 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -67.82 -48.62 65.72 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.047 -0.979 . . . . 0.0 109.781 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -60.9 -58.8 11.9 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 119.866 -1.159 . . . . 0.0 111.345 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.602 ' H ' HD12 ' B' ' 425' ' ' ILE . 3.4 mp -56.27 -39.55 60.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.503 179.152 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.576 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.8 tpt180 -61.84 -52.31 64.69 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.342 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.644 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -45.6 -42.01 10.7 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.979 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -60.28 -58.18 9.62 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.521 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.581 ' O ' ' CD2' ' B' ' 432' ' ' LEU . 2.9 tm-20 -52.92 -17.18 1.28 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.552 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.504 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 1.4 m-80 -81.02 -38.92 26.66 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.096 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.658 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -62.61 -45.26 93.68 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.916 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.816 ' C ' HD23 ' B' ' 432' ' ' LEU . 0.1 OUTLIER -83.29 1.86 38.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.756 179.455 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.784 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.2 OUTLIER -78.83 6.94 7.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.213 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.574 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 84.4 m-20 -130.12 83.76 2.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.89 0.376 . . . . 0.0 111.379 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.579 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.2 OUTLIER -48.27 -53.97 15.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.514 179.682 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.579 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 3.5 mmpt? -54.4 -42.21 70.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.555 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.794 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.3 OUTLIER -70.59 -34.55 72.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.805 179.21 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.592 HD22 HG13 ' B' ' 378' ' ' ILE . 7.2 mt -65.62 -63.96 0.97 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 439' ' ' ASP . . . . . 0.418 ' O ' ' HB3' ' B' ' 442' ' ' ALA . 44.6 t0 -54.79 -26.9 37.67 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.473 ' HB3' ' O ' ' B' ' 437' ' ' MET . 2.7 t80 -61.55 -44.0 97.83 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.499 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.42 ' CE2' ' HG2' ' B' ' 437' ' ' MET . 49.7 m-85 -69.86 -26.67 64.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.18 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' B' ' 439' ' ' ASP . . . -59.69 -48.77 80.34 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.351 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -63.36 -41.93 98.87 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.768 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.612 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.8 OUTLIER -62.48 -34.5 76.96 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.115 0.483 . . . . 0.0 109.808 178.857 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.618 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -57.41 -57.82 11.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.005 179.144 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -63.74 -26.08 68.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.297 179.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' B' ' 449' ' ' PRO . . . -74.79 -76.46 0.14 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.353 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.612 HG23 ' O ' ' B' ' 444' ' ' GLN . 1.1 pt -24.89 87.26 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.998 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 449' ' ' PRO . . . . . 0.501 ' N ' ' O ' ' B' ' 447' ' ' ALA . 74.2 Cg_exo -51.21 -18.55 5.09 Favored 'Trans proline' 0 C--O 1.23 0.109 0 C-N-CA 123.013 2.475 . . . . 0.0 112.765 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 52.76 76.02 0.21 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.8 0.333 . . . . 0.0 110.347 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 60.4 p 60.08 -153.44 0.38 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.611 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -156.25 22.43 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.815 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 17.9 p . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.916 -179.99 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 1.01 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.433 1.597 0 C5'-C4'-C3' 110.958 -3.028 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 1.01 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.281 0 O4'-C1'-N19 111.25 3.05 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.635 " O2'" " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.533 0 C5'-C4'-C3' 111.044 -2.97 . 0.466 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 1.009 " O2'" " H5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.098 0 O4'-C1'-N19 111.503 3.303 . 0.167 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 1.009 " H5'" " O2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.191 0 O4'-C1'-N19 111.093 2.893 . 0.362 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.592 " H5'" " O2'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 C3'-C2'-C1' 104.301 3.113 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.589 " C5'" HO2' ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.839 0 O4'-C1'-N19 111.335 3.135 . 0.086 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.628 ' N4 ' ' H62' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.284 0 O4'-C1'-N19 111.246 3.046 . 0.159 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.628 ' H62' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.421 0 O4'-C1'-N19 111.033 2.833 . 0.275 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.535 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.431 -1.871 0 C5'-C4'-C3' 111.172 -2.885 . 0.03 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.612 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.437 0 O4'-C1'-N19 111.333 3.133 . 0.024 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.914 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.907 0 C5'-C4'-C3' 111.351 -2.766 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.914 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.668 0 C3'-C2'-C1' 104.578 3.42 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.77 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.539 0 C5'-C4'-C3' 111.162 -2.892 . 0.13 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.997 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -2.012 0 C5'-C4'-C3' 110.888 -3.075 . 0.01 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.997 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.138 0 O4'-C1'-N19 111.631 3.431 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.493 " O2'" " O4'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.089 0 C5'-C4'-C3' 110.843 -3.105 OUTLIER-DELTA 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.639 ' H61' " C2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.884 0 C5'-C4'-C3' 110.879 -3.08 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.553 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.13 0 C5'-C4'-C3' 111.107 -2.929 . 0.026 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.787 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.764 0 C5'-C4'-C3' 110.982 -3.012 . 0.15 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.771 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.449 0 C5'-C4'-C3' 110.896 -3.069 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.917 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.613 1.974 0 O4'-C1'-N19 111.174 2.974 . 0.018 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.71 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.109 0 O4'-C1'-N19 111.905 3.705 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.74 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.176 0 C5'-C4'-C3' 111.483 -2.678 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.432 " H5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.127 0 O4'-C1'-N19 111.463 3.263 . 0.209 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.515 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.466 0 O4'-C1'-N19 111.235 3.035 . 0.127 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.606 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.17 0 O4'-C1'-N19 111.06 2.86 . 0.108 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.642 " O2'" " C5'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.61 0 C3'-C2'-C1' 104.677 3.53 . 0.035 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.678 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.265 0 O4'-C1'-N19 111.26 3.06 . 0.169 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.941 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.443 2.397 0 O4'-C1'-N19 111.334 3.134 . 0.083 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.941 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.384 0 O4'-C1'-N19 111.454 3.254 . 0.226 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.551 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.521 0 C5'-C4'-C3' 111.199 -2.867 . 0.437 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.197 0 N-CA-C 112.582 -0.207 . . . . 0.0 112.582 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 365' ' ' SER . . . . . 0.45 ' O ' ' C ' ' B' ' 366' ' ' LEU . 4.5 t -81.71 61.36 5.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.752 0.31 . . . . 0.0 110.902 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.523 ' O ' ' C ' ' B' ' 367' ' ' ASP . 0.1 OUTLIER -28.69 -45.74 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.751 -179.699 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.639 ' O ' ' HB3' ' B' ' 370' ' ' ALA . 0.5 OUTLIER -15.84 -58.07 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 O-C-N 123.742 0.651 . . . . 0.0 111.703 -179.609 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.486 ' O ' ' HG3' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -44.36 -62.36 1.2 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.017 179.23 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.514 ' N ' ' O ' ' B' ' 366' ' ' LEU . 0.9 OUTLIER -53.23 -32.95 50.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.37 179.114 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.791 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -58.0 -81.56 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.463 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.486 ' HG3' ' O ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -37.33 -44.82 0.63 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.129 0.49 . . . . 0.0 110.175 179.519 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.543 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.7 OUTLIER -57.26 -47.32 81.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.47 179.343 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.542 ' NE2' ' HG ' ' B' ' 377' ' ' LEU . 0.1 OUTLIER -57.71 -44.15 85.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.147 0.498 . . . . 0.0 111.159 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.753 ' N ' HD23 ' B' ' 374' ' ' LEU . 0.6 OUTLIER -59.16 -70.13 0.17 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -178.393 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.469 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.0 m-85 -83.36 -32.34 26.28 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -177.416 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -81.56 -24.79 36.32 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -178.913 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.844 ' O ' HD13 ' B' ' 378' ' ' ILE . 2.4 mm? -117.3 -18.96 9.78 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.844 HD13 ' O ' ' B' ' 377' ' ' LEU . 1.6 mm -144.12 44.99 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.832 0.349 . . . . 0.0 111.342 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.469 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -165.43 60.56 0.24 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.692 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.62 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 22.3 p90 -63.45 -56.98 11.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.776 0.322 . . . . 0.0 110.512 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.62 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 166.7 31.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.986 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.411 ' HB3' ' CE2' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -169.81 28.85 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.856 0.36 . . . . 0.0 110.981 179.806 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.574 ' O ' ' N ' ' B' ' 385' ' ' LEU . 0.2 OUTLIER -108.12 20.34 18.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.459 179.803 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.47 ' HB3' ' HA3' ' B' ' 407' ' ' GLY . 0.6 OUTLIER 26.49 37.58 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 O-C-N 123.786 0.679 . . . . 0.0 111.689 179.597 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.863 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.5 OUTLIER -67.17 130.86 44.45 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.948 0.404 . . . . 0.0 110.544 -179.805 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.577 ' O ' ' CD2' ' B' ' 386' ' ' HIS . 5.4 p-80 -167.7 133.23 1.97 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.316 0.579 . . . . 0.0 112.194 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.918 ' CE2' ' HB1' ' B' ' 427' ' ' ALA . 34.4 m-85 -85.71 -177.25 6.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.033 178.437 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.542 HG23 ' O ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -160.42 111.51 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.3 0.572 . . . . 0.0 111.358 178.286 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.9 m -74.61 116.13 14.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.954 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.821 HG23 HG23 ' B' ' 401' ' ' ILE . 23.9 m -126.1 151.16 32.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.582 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.532 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 79.42 49.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.474 -179.673 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.442 ' C ' ' O ' ' B' ' 391' ' ' LYS . 36.1 mttt -32.3 127.33 0.35 Allowed Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.11 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.605 ' O ' HG22 ' B' ' 394' ' ' THR . 12.3 Cg_endo -56.8 -170.77 0.03 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.723 2.282 . . . . 0.0 112.064 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.605 HG22 ' O ' ' B' ' 393' ' ' PRO . 0.1 OUTLIER -168.33 168.3 11.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.001 -179.906 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -71.6 -10.22 59.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.923 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 33.5 m -128.28 12.87 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 CA-C-O 121.378 0.609 . . . . 0.0 110.104 178.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.574 ' HB3' HG23 ' B' ' 394' ' ' THR . 0.2 OUTLIER -164.24 56.68 0.52 Allowed Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.913 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.571 ' HD3' ' N ' ' B' ' 397' ' ' ASP . 50.2 Cg_exo -53.75 -19.19 14.01 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.093 2.529 . . . . 0.0 113.166 -179.243 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.569 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 43.9 p-10 -65.09 139.57 58.73 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 121.301 0.572 . . . . 0.0 111.474 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 400' ' ' SER . . . . . 0.549 ' O ' ' HA ' ' B' ' 416' ' ' VAL . 17.6 t -137.41 161.08 37.28 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.771 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.869 HD13 ' HB ' ' B' ' 416' ' ' VAL . 4.8 tp -128.79 113.04 27.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 121.18 0.514 . . . . 0.0 111.243 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.915 ' O ' HG22 ' B' ' 414' ' ' THR . 1.9 t -79.3 164.31 3.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.846 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.542 ' O ' HG23 ' B' ' 388' ' ' VAL . 1.3 mm-40 -133.23 106.36 7.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.174 0.511 . . . . 0.0 110.812 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.543 ' SG ' ' CE2' ' B' ' 387' ' ' TYR . 2.0 t -85.9 108.59 18.23 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.481 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -140.26 151.7 45.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.072 0.463 . . . . 0.0 111.375 -179.379 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.863 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -123.35 126.78 73.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.512 -179.248 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 407' ' ' GLY . . . . . 0.47 ' HA3' ' HB3' ' B' ' 384' ' ' ARG . . . -28.52 -35.67 0.01 OUTLIER Glycine 0 C--N 1.331 0.277 0 CA-C-N 115.652 -0.704 . . . . 0.0 113.758 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 408' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' B' ' 406' ' ' VAL . 58.9 t0 -53.36 -20.98 5.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.231 0.539 . . . . 0.0 110.151 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 101.8 42.88 2.2 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.081 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.583 HG22 HD13 ' B' ' 412' ' ' LEU . 13.9 m -137.79 133.24 33.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.921 0.391 . . . . 0.0 111.774 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.475 ' HA ' ' O ' ' B' ' 404' ' ' CYS . 42.9 t -94.63 88.13 2.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.61 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.838 HD12 ' HG3' ' B' ' 437' ' ' MET . 0.1 OUTLIER -51.47 -13.63 0.24 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.316 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.429 ' N ' ' HB3' ' B' ' 404' ' ' CYS . . . 153.51 -165.65 31.5 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 119.62 -1.276 . . . . 0.0 113.39 178.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.915 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -142.27 173.77 11.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.75 0.31 . . . . 0.0 110.563 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.712 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -146.61 98.9 0.2 Allowed Glycine 0 C--O 1.225 -0.416 0 C-N-CA 120.324 -0.941 . . . . 0.0 112.626 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.869 ' HB ' HD13 ' B' ' 401' ' ' ILE . 13.5 p -105.45 157.46 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.893 0.347 . . . . 0.0 110.193 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.788 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . 166.63 138.13 2.37 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 119.422 -1.37 . . . . 0.0 113.496 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.541 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.1 OUTLIER -47.09 -67.41 0.28 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.005 0.431 . . . . 0.0 109.957 179.403 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.784 ' O ' ' N ' ' B' ' 421' ' ' LYS . 2.0 p30 -85.01 91.81 8.18 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 176.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.817 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.9 OUTLIER -17.74 -31.5 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -177.411 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.784 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.6 OUTLIER -44.83 -57.05 3.99 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.831 179.011 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.788 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.2 OUTLIER -44.98 -39.44 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.569 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.579 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.817 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -63.35 -37.6 87.9 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.827 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -70.31 -65.48 2.51 Favored Glycine 0 C--N 1.334 0.45 0 C-N-CA 120.206 -0.997 . . . . 0.0 111.724 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.481 ' H ' HD12 ' B' ' 425' ' ' ILE . 3.1 mp -53.76 -35.39 26.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.228 179.252 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.578 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 1.7 tpt180 -61.59 -53.27 58.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.002 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.918 ' HB1' ' CE2' ' B' ' 387' ' ' TYR . . . -45.51 -45.88 13.57 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.916 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.791 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -56.54 -72.39 0.08 Allowed 'General case' 0 C--O 1.238 0.467 0 CA-C-O 121.147 0.499 . . . . 0.0 110.216 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.542 ' HA ' HD21 ' B' ' 432' ' ' LEU . 19.9 mt-10 -45.61 -25.77 0.51 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.026 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.474 ' ND2' ' HD2' ' B' ' 426' ' ' ARG . 1.3 m-80 -72.33 -34.22 67.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.218 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.682 ' HB3' HD22 ' B' ' 374' ' ' LEU . . . -65.83 -43.96 86.98 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.451 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.886 ' CA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -101.42 25.93 7.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.021 0.439 . . . . 0.0 110.645 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.515 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 20.3 ttt180 -94.4 -9.84 34.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.07 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.444 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 3.6 m-20 -109.29 95.13 5.42 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.786 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.546 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 2.5 ptmt -56.33 -31.64 63.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.5 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.546 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 5.9 mtpt -66.15 -54.86 20.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.525 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.838 ' HG3' HD12 ' B' ' 412' ' ' LEU . 17.5 tmm? -63.86 -46.94 82.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.299 179.416 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.886 HD11 ' CA ' ' B' ' 432' ' ' LEU . 71.4 mt -55.24 -59.05 5.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.961 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -64.49 -24.68 67.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.678 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.602 ' CE2' ' CZ ' ' B' ' 441' ' ' TYR . 0.1 OUTLIER -62.28 -47.29 84.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.134 0.493 . . . . 0.0 109.783 179.561 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.602 ' CZ ' ' CE2' ' B' ' 440' ' ' PHE . 64.9 m-85 -76.94 -41.51 42.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.153 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -44.01 -45.19 7.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.97 -45.67 66.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.288 178.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.673 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -52.32 -24.52 7.66 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.652 178.86 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.612 HH11 HD11 ' B' ' 448' ' ' ILE . 0.2 OUTLIER -79.18 -66.07 0.92 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.04 -179.846 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -45.8 -25.95 0.59 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.432 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . -78.94 -53.07 7.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.861 0.362 . . . . 0.0 111.187 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.673 HG23 ' O ' ' B' ' 444' ' ' GLN . 2.9 pt -52.74 129.81 46.37 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.35 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -68.37 -176.26 1.07 Allowed 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.735 2.29 . . . . 0.0 112.389 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -139.73 80.58 1.78 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.918 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 1.3 m -130.71 -47.98 1.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.858 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.41 94.22 8.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.88 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 57.7 p . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.875 -179.918 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.862 ' H8 ' " O5'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.663 0 O4'-C1'-N19 111.262 3.062 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.528 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.349 0 O4'-C1'-N19 111.307 3.107 . 0.208 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.528 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.706 0 C3'-C2'-C1' 104.29 3.1 . 0.102 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.508 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.238 0 O4'-C1'-N19 111.171 2.971 . 0.124 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.609 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.088 0 O4'-C1'-N19 111.063 2.863 . 0.184 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.519 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.279 0 O4'-C1'-N19 111.057 2.857 . 0.096 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.671 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.14 0 O4'-C1'-N19 111.256 3.056 . 0.18 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.693 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.254 0 O4'-C1'-N19 111.133 2.933 . 0.355 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.693 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 C5'-C4'-C3' 111.122 -2.919 . 0.075 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.64 " O2'" " C5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.437 1.927 0 C5'-C4'-C3' 111.12 -2.92 . 0.123 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.64 " C5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.635 0 C5'-C4'-C3' 110.926 -3.049 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.664 " O2'" " C5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.003 0 O4'-C1'-N19 111.348 3.148 . 0.113 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.667 " O2'" " H5'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.28 0 O4'-C1'-N19 111.649 3.449 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.667 " H5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.429 -1.993 0 C5'-C4'-C3' 111.054 -2.964 . 0.027 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.889 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.251 0 C5'-C4'-C3' 110.971 -3.02 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.889 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -2.017 0 O4'-C1'-N19 111.948 3.748 OUTLIER-DELTA 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.494 " O2'" " C1'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.083 0 C5'-C4'-C3' 110.964 -3.024 OUTLIER-DELTA 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.761 " H2'" " O4'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.435 1.715 0 O4'-C1'-N19 111.207 3.007 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.761 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.832 0 O4'-C1'-N19 111.199 2.999 . 0.022 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.778 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.943 0 C5'-C4'-C3' 110.872 -3.085 OUTLIER-DELTA 0.0 OUTLIER '7D dist &a' 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.584 " C5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.817 0 O4'-C1'-N19 111.302 3.102 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.834 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.011 0 C5'-C4'-C3' 111.055 -2.963 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.67 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.314 0 O4'-C1'-N19 111.875 3.675 . 0.089 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.801 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.249 0 C5'-C4'-C3' 111.437 -2.709 . 0.068 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.645 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.345 0 O4'-C1'-N19 111.436 3.236 . 0.397 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.645 ' C6 ' ' C6 ' ' A' ' 25' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.281 0 O4'-C1'-N19 111.505 3.305 . 0.102 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.694 ' H6 ' " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.005 0 C5'-C4'-C3' 111.138 -2.908 . 0.231 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.635 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.582 0 C3'-C2'-C1' 104.829 3.699 . 0.011 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.721 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.106 0 O4'-C1'-N19 110.985 2.785 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 1.047 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.195 0 O4'-C1'-N19 111.525 3.325 . 0.287 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 1.047 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.604 0 O4'-C1'-N19 111.373 3.173 . 0.193 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.457 " O5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.396 0 O4'-C1'-N19 111.199 2.999 . 0.209 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 364' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' B' ' 366' ' ' LEU . . . . . . . . 0 N--CA 1.487 2.093 0 N-CA-C 112.604 -0.198 . . . . 0.0 112.604 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.65 80.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.797 0.332 . . . . 0.0 110.604 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.505 ' N ' ' O ' ' B' ' 364' ' ' GLY . 11.6 tp -135.0 124.84 25.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.98 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.5 OUTLIER -55.73 -63.3 1.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.174 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.474 ' HA ' ' NZ ' ' B' ' 371' ' ' LYS . 2.1 ttp -36.2 -52.67 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.355 179.352 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.437 ' HB2' ' HB3' ' B' ' 366' ' ' LEU . 3.3 m-20 -61.46 -42.0 98.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.161 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 1.006 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -65.41 -83.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.943 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.529 ' HB2' " O4'" ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -26.67 -49.91 0.04 OUTLIER 'General case' 0 C--O 1.235 0.301 0 O-C-N 123.428 0.455 . . . . 0.0 111.053 179.769 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.476 ' O ' ' HB2' ' B' ' 376' ' ' SER . 35.7 ttp85 -54.08 -61.97 1.96 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.359 179.168 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.575 ' HG2' HD22 ' B' ' 377' ' ' LEU . 0.0 OUTLIER -47.61 -54.53 11.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 111.09 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.469 HD11 ' CB ' ' B' ' 428' ' ' ALA . 7.7 mt -42.86 -67.85 0.24 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -178.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.536 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-30 -93.16 -48.3 6.53 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.601 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.476 ' HB2' ' O ' ' B' ' 372' ' ' ARG . 11.9 m -60.61 -13.94 17.37 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 121.259 -0.176 . . . . 0.0 111.338 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.778 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.9 OUTLIER -125.43 -29.12 3.26 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.235 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.778 HD13 ' O ' ' B' ' 377' ' ' LEU . 6.8 mm -142.88 44.2 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -178.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.536 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -142.48 74.77 0.33 Allowed Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.719 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.56 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 0.1 OUTLIER -100.41 -76.67 0.55 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.745 0.307 . . . . 0.0 110.803 179.876 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.56 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 168.1 82.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.008 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 25.1 t 176.58 -69.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.618 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.645 HD23 ' N ' ' B' ' 383' ' ' LEU . 1.6 pt? -41.99 -28.15 0.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.822 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' B' ' 407' ' ' GLY . 0.7 OUTLIER 62.93 53.27 2.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.748 -179.721 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.82 ' HG ' HG12 ' B' ' 406' ' ' VAL . 6.1 tt -76.7 127.6 33.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.664 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.52 ' N ' HD23 ' B' ' 385' ' ' LEU . 14.3 p-80 -152.07 140.83 20.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.52 0.676 . . . . 0.0 112.366 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.504 ' OH ' ' HA ' ' B' ' 428' ' ' ALA . 40.5 m-85 -91.89 160.65 15.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.869 179.347 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.66 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -136.97 138.25 46.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.118 179.067 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 389' ' ' THR . . . . . 0.525 ' O ' ' CG2' ' B' ' 389' ' ' THR . 0.4 OUTLIER -100.08 113.49 26.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.708 -179.786 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.987 HG23 HG23 ' B' ' 401' ' ' ILE . 32.0 m -122.52 147.37 26.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.413 0.625 . . . . 0.0 111.42 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.624 ' CB ' HG22 ' B' ' 401' ' ' ILE . 9.3 tmtt? 80.55 55.97 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.961 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.444 ' C ' ' O ' ' B' ' 391' ' ' LYS . 2.8 mmtt -34.55 142.69 0.23 Allowed Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.672 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.596 ' HB2' " O2'" ' A' ' 5' ' ' ' U' . 14.6 Cg_exo -65.67 162.95 32.18 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.214 1.943 . . . . 0.0 111.845 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 22.8 p -132.29 158.99 40.43 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.855 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 395' ' ' ALA . . . . . 0.42 ' HB1' " H1'" ' A' ' 30' ' ' ' C' . . . -82.01 7.66 12.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.517 179.011 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 396' ' ' VAL . . . . . 0.767 HG23 ' OD2' ' B' ' 397' ' ' ASP . 20.5 m -128.67 -15.72 2.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.313 178.357 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.767 ' OD2' HG23 ' B' ' 396' ' ' VAL . 1.3 m-20 -158.83 65.41 2.88 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.543 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.45 ' HB3' " C4'" ' A' ' 5' ' ' ' U' . 74.7 Cg_exo -40.86 -40.31 3.56 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 123.607 2.871 . . . . 0.0 114.092 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.522 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 3.0 p-10 -33.74 140.7 0.05 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.049 0.452 . . . . 0.0 111.502 -178.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 2.7 m -143.23 163.0 34.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.466 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.987 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -123.74 140.92 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 121.211 0.529 . . . . 0.0 111.557 -179.273 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.851 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -102.84 179.3 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.121 179.479 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.66 ' CB ' HG23 ' B' ' 388' ' ' VAL . 0.1 OUTLIER -149.97 108.38 3.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.024 0.44 . . . . 0.0 110.531 178.902 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.903 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 1.8 t -82.55 116.88 22.17 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.598 ' HA ' ' O ' ' B' ' 410' ' ' THR . 2.5 ptm180 -152.16 172.32 16.54 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.416 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.82 HG12 ' HG ' ' B' ' 385' ' ' LEU . 3.7 m -139.86 138.37 38.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.895 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 407' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' B' ' 384' ' ' ARG . . . -35.66 -36.83 0.12 Allowed Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 116.105 -0.498 . . . . 0.0 113.326 -179.26 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -55.55 -17.51 5.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.046 0.45 . . . . 0.0 110.382 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 95.66 45.81 2.85 Favored Glycine 0 N--CA 1.445 -0.718 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.625 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.699 ' HB ' HG22 ' B' ' 406' ' ' VAL . 37.4 m -131.55 112.59 12.76 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 -179.138 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' B' ' 404' ' ' CYS . 30.4 t -84.43 86.64 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.416 179.006 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.762 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.0 OUTLIER -46.36 -23.1 0.31 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.98 -179.528 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.27 -154.51 25.4 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.042 -1.075 . . . . 0.0 113.383 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.676 HG22 HD11 ' B' ' 401' ' ' ILE . 3.3 m -155.99 154.64 31.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.73 -0.235 . . . . 0.0 110.472 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.648 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -139.94 160.81 26.28 Favored Glycine 0 C--O 1.224 -0.523 0 C-N-CA 119.691 -1.242 . . . . 0.0 113.981 -179.48 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.402 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 1.4 p -146.52 145.57 19.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.694 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -161.69 132.71 2.92 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.061 -1.066 . . . . 0.0 113.246 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.518 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 6.6 ttm180 -54.33 -53.58 51.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.948 0.404 . . . . 0.0 110.896 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.849 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -79.48 -15.88 57.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.136 179.343 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.849 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 93.23 -42.69 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.159 0 C-N-CA 123.434 0.693 . . . . 0.0 111.536 -179.514 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.577 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.1 OUTLIER -52.63 -45.89 66.82 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.01 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.778 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -52.95 -36.58 24.17 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.691 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 177.648 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.851 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -66.75 -43.4 84.23 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.556 178.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.87 -64.95 3.3 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.258 -0.972 . . . . 0.0 111.144 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.548 ' O ' ' HB3' ' B' ' 428' ' ' ALA . 53.6 mt -52.97 -41.54 41.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.852 0.358 . . . . 0.0 110.471 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.598 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 6.4 tpt180 -57.66 -55.86 29.37 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.495 ' HA ' ' OD1' ' B' ' 430' ' ' ASN . . . -40.81 -44.88 2.34 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 1.006 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -53.04 -62.96 1.31 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.648 178.512 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.467 ' HA ' HD11 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -48.29 -31.83 6.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.35 179.117 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.495 ' OD1' ' HA ' ' B' ' 427' ' ' ALA . 9.1 m120 -67.56 -31.69 71.93 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.785 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.903 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -70.96 -48.26 54.38 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.763 0.316 . . . . 0.0 110.643 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.928 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -89.94 14.38 12.31 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.756 179.486 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.53 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 8.6 ttt-85 -86.08 3.28 43.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.426 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.513 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 3.7 t70 -126.5 92.39 3.55 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.115 0.484 . . . . 0.0 111.011 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.536 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -55.86 -32.88 64.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.668 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.536 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 15.6 mtmm -66.92 -59.22 3.7 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.518 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.762 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.9 OUTLIER -55.53 -51.78 65.89 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.286 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.928 HD11 ' HA ' ' B' ' 432' ' ' LEU . 96.0 mt -53.58 -65.65 0.53 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 178.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -42.09 -37.56 1.44 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.366 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.533 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -63.81 -42.77 97.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.633 179.439 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.559 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 50.4 m-85 -71.91 -35.8 69.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.262 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.72 -48.37 63.62 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -38.59 90.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.628 178.479 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.559 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -64.96 -23.16 67.14 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.233 179.516 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.755 ' O ' HD11 ' B' ' 448' ' ' ILE . 13.7 tpt180 -86.79 -28.57 22.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.143 -179.293 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -88.09 -41.33 13.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.924 0.392 . . . . 0.0 110.845 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.451 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -61.96 -46.92 87.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.08 -179.417 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.755 HD11 ' O ' ' B' ' 445' ' ' ARG . 0.7 OUTLIER -30.33 105.22 0.22 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.602 -179.801 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -47.08 164.92 0.1 Allowed 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.843 2.362 . . . . 0.0 112.358 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -155.29 83.22 1.06 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.83 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 451' ' ' SER . . . . . 0.43 ' O ' ' O ' ' B' ' 452' ' ' GLU . 0.3 OUTLIER 67.84 171.84 0.27 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.773 -179.809 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 452' ' ' GLU . . . . . 0.526 ' O ' ' CB ' ' B' ' 453' ' ' SER . 0.0 OUTLIER 60.03 139.89 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.67 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 453' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' B' ' 452' ' ' GLU . 3.4 p . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.905 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.846 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.435 1.741 0 O4'-C1'-N19 111.323 3.123 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.846 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.308 0 O4'-C1'-N19 111.308 3.108 . 0.125 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.576 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.745 0 C3'-C2'-C1' 104.917 3.797 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.576 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.262 0 O4'-C1'-N19 111.18 2.98 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.59 " O2'" ' HB2' ' B' ' 393' ' ' PRO . . . . . . . . 0 O4'--C1' 1.439 2.098 0 O4'-C1'-N19 111.137 2.937 . 0.159 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.501 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.293 0 O4'-C1'-N19 111.462 3.262 . 0.129 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.661 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.904 0 C5'-C4'-C3' 111.122 -2.918 . 0.182 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.567 ' N4 ' ' N4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.359 0 O4'-C1'-N19 111.469 3.269 . 0.158 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.65 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.263 0 O4'-C1'-N19 111.124 2.924 . 0.163 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.65 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.455 0 O4'-C1'-N19 111.229 3.029 . 0.126 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.584 " O4'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.406 0 C5'-C4'-C3' 111.349 -2.768 . 0.047 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.719 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.014 0 O4'-C1'-N19 111.477 3.277 . 0.06 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.719 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.155 0 O4'-C1'-N19 111.294 3.094 . 0.089 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.512 ' N4 ' ' C4 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.0 0 O4'-C1'-N19 111.044 2.844 . 0.503 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.874 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 P--O5' 1.611 1.83 0 C5'-C4'-C3' 111.038 -2.975 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.874 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.22 0 C5'-C4'-C3' 110.904 -3.064 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.682 " O2'" ' N9 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.366 0 C5'-C4'-C3' 111.047 -2.969 OUTLIER-EPSILON 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.682 ' N9 ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 1.961 0 C5'-C4'-C3' 111.036 -2.976 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.555 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.306 0 C5'-C4'-C3' 111.209 -2.861 . 0.068 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.631 " O2'" " C5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.742 0 O4'-C1'-N19 111.333 3.133 . 0.037 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.644 " O2'" " C5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.991 0 O4'-C1'-N19 111.296 3.096 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.833 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.922 0 O4'-C1'-N19 111.235 3.035 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.808 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.186 0 C5'-C4'-C3' 111.199 -2.868 . 0.031 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.803 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.555 0 C3'-C2'-C1' 104.873 3.747 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.442 2.359 0 O4'-C1'-N19 111.167 2.967 . 0.054 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.493 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.611 0 C3'-C2'-C1' 104.333 3.147 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.493 " O5'" " O2'" ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.127 0 O4'-C1'-N19 111.222 3.022 . 0.137 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.605 " O2'" " O5'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.436 0 C3'-C2'-C1' 104.068 2.853 . 0.09 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.605 " O5'" " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.133 0 O4'-C1'-N19 111.064 2.864 . 0.17 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.777 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.326 0 O4'-C1'-N19 111.271 3.071 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.784 " O2'" " H5'" ' A' ' 32' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.396 0 O4'-C1'-N19 111.437 3.237 . 0.411 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.784 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.508 0 C5'-C4'-C3' 111.269 -2.82 . 0.578 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.159 0 N-CA-C 112.435 -0.266 . . . . 0.0 112.435 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 365' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' B' ' 368' ' ' MET . 0.3 OUTLIER -132.5 36.03 3.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.957 0.408 . . . . 0.0 110.813 179.744 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.61 HD12 ' OE2' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -46.17 -20.42 0.1 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.846 -0.616 . . . . 0.0 112.046 -179.617 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.524 ' HA ' HG23 ' B' ' 425' ' ' ILE . 0.5 OUTLIER -42.63 -70.94 0.09 Allowed 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.033 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.487 ' HA ' ' HD2' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -29.94 -65.06 0.11 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.947 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.453 ' CG ' ' CE ' ' B' ' 368' ' ' MET . 2.9 m120 -42.27 -49.22 5.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.798 0.332 . . . . 0.0 110.486 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.822 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -58.95 -79.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.42 179.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.487 ' HD2' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -36.22 -40.97 0.24 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.086 0.47 . . . . 0.0 110.17 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.539 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.2 tmm_? -59.4 -63.52 1.27 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.278 179.221 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.62 ' HB3' HD22 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -45.56 -34.98 3.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.394 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.758 HD11 ' HA ' ' B' ' 428' ' ' ALA . 1.3 mt -68.44 -76.73 0.09 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.523 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.9 m-30 -84.91 21.58 1.56 Allowed 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.118 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -131.02 -36.7 1.32 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.731 0.3 . . . . 0.0 111.04 179.706 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.653 ' O ' HD13 ' B' ' 378' ' ' ILE . 2.1 mp -102.89 -27.55 12.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.161 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.653 HD13 ' O ' ' B' ' 377' ' ' LEU . 3.6 mm -139.91 37.43 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.134 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.444 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.523 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -126.52 93.36 0.4 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.351 -0.928 . . . . 0.0 112.909 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.475 ' CD2' ' HG2' ' B' ' 445' ' ' ARG . 42.8 p90 -105.43 -169.72 1.64 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.712 0.292 . . . . 0.0 110.291 179.335 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.613 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -87.19 109.41 19.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.26 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.613 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 10.7 t 104.1 37.26 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.755 0.66 . . . . 0.0 111.782 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.541 ' CD1' ' O ' ' B' ' 378' ' ' ILE . 2.8 tt -87.43 -49.43 7.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.11 0.481 . . . . 0.0 110.056 179.014 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.479 ' HB3' ' HA3' ' B' ' 407' ' ' GLY . 0.0 OUTLIER 72.08 35.7 1.24 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.406 178.758 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.633 HD12 HG12 ' B' ' 406' ' ' VAL . 0.3 OUTLIER -40.21 140.8 0.56 Allowed 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.617 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.556 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 1.4 t60 -128.24 83.31 2.15 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 -178.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.591 ' CE1' ' SG ' ' B' ' 404' ' ' CYS . 3.9 m-85 -83.84 116.98 23.0 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.104 177.275 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.82 113.78 44.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.9 0.381 . . . . 0.0 111.074 -179.823 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 54.3 m -77.37 127.92 33.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.348 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.773 HG23 HG23 ' B' ' 401' ' ' ILE . 31.8 m -134.6 151.54 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.097 0.475 . . . . 0.0 111.448 -179.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.503 ' HB3' ' O ' ' B' ' 390' ' ' VAL . 10.7 tppt? 83.31 54.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.952 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.444 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 0.0 OUTLIER -34.95 142.83 0.24 Allowed Pre-proline 0 C--N 1.332 -0.153 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.415 179.842 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.59 ' HB2' " O2'" ' A' ' 5' ' ' ' U' . 2.7 Cg_exo -74.3 155.54 46.36 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 122.34 2.027 . . . . 0.0 113.434 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.487 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 1.7 p -138.69 165.96 25.61 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.507 -1.224 . . . . 0.0 111.762 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 395' ' ' ALA . . . . . 0.63 ' HB1' " H1'" ' A' ' 30' ' ' ' C' . . . -86.89 12.9 9.99 Favored 'General case' 0 CA--C 1.527 0.088 0 CA-C-O 121.33 0.586 . . . . 0.0 110.276 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 3.7 m -138.52 18.91 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.507 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.442 ' H ' ' CD ' ' B' ' 398' ' ' PRO . 0.8 OUTLIER 162.77 55.82 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.28 -179.538 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.502 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 3.9 Cg_endo -46.52 -48.79 13.0 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 123.623 2.882 . . . . 0.0 112.745 -179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.579 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.6 OUTLIER -32.57 130.28 0.18 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.028 -178.814 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 13.8 m -132.58 159.51 39.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.392 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.773 HG23 HG23 ' B' ' 390' ' ' VAL . 16.8 tt -117.32 164.79 13.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.962 0.41 . . . . 0.0 111.221 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.609 HG23 ' O ' ' B' ' 415' ' ' GLY . 0.2 OUTLIER -135.69 138.67 47.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.013 -179.001 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.494 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 6.5 mt-10 -101.35 126.15 48.07 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.591 ' SG ' ' CE1' ' B' ' 387' ' ' TYR . 19.0 t -109.03 102.35 11.34 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.883 ' HB3' HG22 ' B' ' 411' ' ' VAL . 17.9 ptt180 -143.45 111.47 6.12 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.352 0.596 . . . . 0.0 111.485 -178.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.826 HG13 HD21 ' B' ' 412' ' ' LEU . 10.2 m -59.05 150.3 5.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.597 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 407' ' ' GLY . . . . . 0.479 ' HA3' ' HB3' ' B' ' 384' ' ' ARG . . . -52.5 -15.72 3.13 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.003 -0.999 . . . . 0.0 113.908 -179.129 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.14 -2.92 14.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.794 0.33 . . . . 0.0 110.564 179.623 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 86.74 41.79 6.66 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.618 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.547 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 21.5 m -140.72 125.37 17.95 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.803 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.883 HG22 ' HB3' ' B' ' 405' ' ' ARG . 54.9 t -87.46 112.58 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.309 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.303 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.826 HD21 HG13 ' B' ' 406' ' ' VAL . 1.2 mm? -67.75 -41.02 84.03 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.205 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . -177.42 -149.05 7.61 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.573 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.494 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -151.08 173.94 13.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.733 0.301 . . . . 0.0 110.906 -179.803 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.609 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -162.09 122.65 1.12 Allowed Glycine 0 C--O 1.227 -0.327 0 C-N-CA 120.186 -1.007 . . . . 0.0 113.066 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.412 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 6.4 p -126.67 149.42 31.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.805 0.336 . . . . 0.0 110.606 179.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.932 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -163.5 158.08 30.42 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.024 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 418' ' ' ARG . . . . . . . . . . . . . 8.8 ptt180 -63.2 -42.26 99.28 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.16 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.859 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.9 OUTLIER -101.46 30.15 4.41 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 179.418 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.745 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.55 -43.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 115.37 1.618 . . . . 0.0 115.37 178.402 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.624 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -48.91 -47.29 43.49 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.711 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.932 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -49.45 -38.34 12.33 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.541 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.745 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -61.92 -48.32 80.98 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.627 178.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.478 ' HA2' HG21 ' B' ' 402' ' ' VAL . . . -63.33 -65.36 3.13 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.319 -0.943 . . . . 0.0 111.404 179.042 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.524 HG23 ' HA ' ' B' ' 367' ' ' ASP . 0.8 OUTLIER -50.37 -32.76 9.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.893 0.377 . . . . 0.0 109.994 178.925 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.593 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 27.6 tpt180 -65.46 -48.07 73.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.929 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.526 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -48.91 -42.1 35.83 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.822 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -58.07 -60.1 4.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.707 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.61 ' OE2' HD12 ' B' ' 366' ' ' LEU . 14.6 mm-40 -48.73 -33.09 9.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.012 179.143 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.494 ' ND2' ' O ' ' B' ' 414' ' ' THR . 1.2 m-80 -65.02 -39.08 92.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.289 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.53 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -62.33 -41.75 98.81 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.156 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.686 HD23 HD21 ' B' ' 374' ' ' LEU . 0.3 OUTLIER -87.33 0.37 55.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.795 179.414 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.473 ' O ' ' HG2' ' B' ' 433' ' ' ARG . 54.8 ttt-85 -88.28 16.45 6.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.977 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.438 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 9.6 m-20 -129.21 76.54 1.73 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.131 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.5 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -51.4 -32.54 26.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.097 0.475 . . . . 0.0 109.87 179.524 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.5 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -69.82 -42.37 73.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.092 179.642 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.489 ' HE2' HD12 ' B' ' 412' ' ' LEU . 13.2 tmm? -76.89 -44.73 30.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.027 179.243 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.634 HD11 ' HA ' ' B' ' 432' ' ' LEU . 68.1 mt -52.84 -67.69 0.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.057 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -53.36 -42.66 67.08 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.681 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.5 ' HB3' ' O ' ' B' ' 436' ' ' LYS . 2.5 t80 -53.7 -32.52 52.19 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.544 ' OH ' HG21 ' B' ' 406' ' ' VAL . 3.7 m-85 -78.7 -30.37 46.01 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.03 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -52.87 -39.52 62.69 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 177.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.15 -42.09 60.49 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.248 177.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.737 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -63.21 -13.8 41.73 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.406 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.686 ' O ' HD11 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -90.41 -46.35 8.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.665 -179.877 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -69.28 -36.22 76.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.129 0.49 . . . . 0.0 109.933 179.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.474 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -74.94 -80.1 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.477 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.737 HG23 ' O ' ' B' ' 444' ' ' GLN . 0.2 OUTLIER 27.14 94.69 0.04 OUTLIER Pre-proline 0 N--CA 1.463 0.188 0 CA-C-O 121.197 0.522 . . . . 0.0 111.601 -179.328 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 449' ' ' PRO . . . . . 0.453 ' O ' ' HB2' ' B' ' 450' ' ' ARG . 63.0 Cg_endo -87.11 -17.57 3.0 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 123.185 2.59 . . . . 0.0 112.623 -179.471 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 450' ' ' ARG . . . . . 0.453 ' HB2' ' O ' ' B' ' 449' ' ' PRO . 0.0 OUTLIER 74.15 31.93 1.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.862 -179.845 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 66.2 m -110.91 176.69 4.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.919 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -127.23 120.42 28.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.923 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.84 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.932 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.67 0 O4'-C1'-N19 111.175 2.975 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.932 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.244 0 O4'-C1'-N19 111.359 3.159 . 0.182 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.585 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.593 0 C3'-C2'-C1' 104.644 3.494 . 0.069 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.585 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.063 0 O4'-C1'-N19 111.202 3.002 . 0.167 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.833 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.021 0 C5'-C4'-C3' 111.407 -2.728 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.979 " O2'" " H5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.428 -2.113 0 O4'-C1'-N19 111.341 3.141 . 0.263 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.979 " H5'" " O2'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.91 0 C5'-C4'-C3' 111.073 -2.951 . 0.119 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.711 ' N4 ' ' N4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.529 0 O4'-C1'-N19 111.421 3.221 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.869 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.122 0 C5'-C4'-C3' 111.366 -2.756 . 0.112 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.869 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 C3'-C2'-C1' 104.67 3.522 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.636 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.576 0 C5'-C4'-C3' 111.294 -2.804 . 0.014 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.799 ' H6 ' " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.435 1.756 0 C5'-C4'-C3' 110.961 -3.026 . 0.019 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.755 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.607 0 C3'-C2'-C1' 104.636 3.485 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.647 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.381 0 C5'-C4'-C3' 111.186 -2.876 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.685 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.165 0 C5'-C4'-C3' 110.976 -3.016 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.685 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.899 0 O4'-C1'-N19 111.275 3.075 OUTLIER-EPSILON 0.067 1b . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.549 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -2.013 0 C5'-C4'-C3' 111.053 -2.965 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.612 ' N3 ' ' HG3' ' B' ' 372' ' ' ARG . . . . . . . . 0 P--O5' 1.611 1.759 0 C5'-C4'-C3' 110.996 -3.003 . 0.01 2a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.489 " H2'" ' C8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.943 0 O4'-C1'-N19 111.043 2.843 . 0.197 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.922 " H2'" " O4'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.862 0 C5'-C4'-C3' 110.928 -3.048 . 0.016 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.922 " O4'" " H2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.341 0 C3'-C2'-C1' 104.375 3.194 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.906 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.611 1.809 0 O4'-C1'-N19 111.213 3.013 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.733 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.159 0 O4'-C1'-N19 111.263 3.063 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.733 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.618 0 C3'-C2'-C1' 104.801 3.668 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.596 " O5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.249 0 O4'-C1'-N19 111.252 3.052 . 0.046 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.49 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.6 0 O4'-C1'-N19 111.019 2.819 . 0.094 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.766 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.125 0 O4'-C1'-N19 110.99 2.79 . 0.143 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.766 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.589 0 C3'-C2'-C1' 104.782 3.647 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.742 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.227 0 O4'-C1'-N19 111.019 2.819 . 0.155 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.907 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.269 0 O4'-C1'-N19 111.44 3.24 . 0.208 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.907 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.461 0 O4'-C1'-N19 111.412 3.212 . 0.237 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.587 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.408 0 C5'-C4'-C3' 111.104 -2.931 . 0.578 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.07 0 N-CA-C 112.467 -0.253 . . . . 0.0 112.467 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 365' ' ' SER . . . . . 0.428 ' HA ' ' CG ' ' B' ' 369' ' ' ASN . 2.0 t 43.84 67.7 0.63 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.846 0.355 . . . . 0.0 111.08 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.568 HD12 ' HG2' ' B' ' 368' ' ' MET . 0.1 OUTLIER -74.53 -174.11 1.97 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.973 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.547 ' OD1' ' N ' ' B' ' 367' ' ' ASP . 0.2 OUTLIER -42.11 -71.5 0.08 Allowed 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.323 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.568 ' HG2' HD12 ' B' ' 366' ' ' LEU . 10.8 ptm -34.74 -43.14 0.17 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.407 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' B' ' 366' ' ' LEU . 1.9 m120 -64.08 -49.85 70.66 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.024 0.44 . . . . 0.0 109.83 179.096 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.657 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -53.73 -78.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.107 179.042 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.501 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -32.5 -50.69 0.25 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.091 -179.587 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.612 ' HG3' ' N3 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -51.96 -45.42 64.4 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.413 179.766 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.546 ' HA ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -58.93 -52.08 67.27 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.366 0.603 . . . . 0.0 110.898 179.775 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.719 ' N ' HD23 ' B' ' 374' ' ' LEU . 1.5 mt -53.68 -73.85 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.429 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -82.65 -33.67 27.73 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.541 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -82.1 -16.38 50.18 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.111 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.546 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.4 OUTLIER -120.19 -24.77 5.87 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.357 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.679 HG22 ' CD1' ' B' ' 383' ' ' LEU . 27.7 mm -124.13 -65.83 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 C-N-CA 120.796 -0.362 . . . . 0.0 111.949 -179.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' B' ' 374' ' ' LEU . . . -56.29 79.06 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.459 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.696 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 2.5 p90 -60.55 -41.46 94.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.498 0.19 . . . . 0.0 111.169 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.696 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 154.99 -20.3 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.893 0.378 . . . . 0.0 111.169 179.685 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 1.7 m -127.29 39.62 3.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.69 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.679 ' CD1' HG22 ' B' ' 378' ' ' ILE . 0.5 OUTLIER -99.2 -36.3 9.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.068 -179.858 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 76.52 48.27 0.07 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.051 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.669 ' HA ' HG12 ' B' ' 406' ' ' VAL . 9.6 tt -89.39 143.11 27.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.56 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.406 ' NE2' ' HG3' ' B' ' 405' ' ' ARG . 14.3 p-80 -164.12 138.27 5.57 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.481 0.658 . . . . 0.0 112.576 -179.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.624 ' HE1' HD21 ' B' ' 385' ' ' LEU . 15.2 m-85 -98.48 142.14 30.46 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.077 178.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.786 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -122.29 116.72 49.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.896 -179.793 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 18.2 m -60.0 85.99 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 177.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.983 HG13 HG23 ' B' ' 401' ' ' ILE . 1.6 p -83.43 132.15 32.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.25 -0.887 . . . . 0.0 111.448 -177.316 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.537 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.9 OUTLIER 90.88 132.88 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.546 -178.348 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.488 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 1.5 mmmm -85.56 123.06 73.19 Favored Pre-proline 0 N--CA 1.464 0.244 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.343 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.488 ' HD3' ' HA ' ' B' ' 392' ' ' LYS . 2.9 Cg_exo -74.64 164.07 34.53 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.979 2.453 . . . . 0.0 113.357 -179.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.436 HG23 ' O ' ' B' ' 397' ' ' ASP . 0.6 OUTLIER -107.74 -158.74 0.66 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.342 179.769 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -89.13 -48.53 7.33 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.551 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 396' ' ' VAL . . . . . 0.596 HG11 " O4'" ' A' ' 31' ' ' ' U' . 2.7 m -111.74 -13.1 11.38 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-O 121.658 0.742 . . . . 0.0 110.266 179.161 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.564 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 0.8 OUTLIER -115.44 44.95 0.39 Allowed Pre-proline 0 C--N 1.318 -0.776 0 CA-C-N 114.53 -1.213 . . . . 0.0 110.966 179.888 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' B' ' 397' ' ' ASP . 13.7 Cg_exo -45.67 -22.21 1.09 Allowed 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.533 2.156 . . . . 0.0 112.062 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' B' ' 398' ' ' PRO . 0.7 OUTLIER -20.26 88.64 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.295 0 O-C-N 123.665 0.603 . . . . 0.0 111.233 179.997 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 400' ' ' SER . . . . . 0.479 ' N ' ' O ' ' B' ' 398' ' ' PRO . 18.0 t -119.21 159.87 23.23 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.283 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.983 HG23 HG13 ' B' ' 390' ' ' VAL . 13.6 tt -112.26 160.61 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-O 121.476 0.655 . . . . 0.0 111.003 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.789 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.4 OUTLIER -120.25 142.04 37.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.786 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.786 ' CB ' HG23 ' B' ' 388' ' ' VAL . 0.3 OUTLIER -106.11 121.33 43.94 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.461 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.565 ' O ' ' N ' ' B' ' 412' ' ' LEU . 2.6 m -101.76 105.93 16.87 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.49 ' HA ' ' O ' ' B' ' 410' ' ' THR . 1.6 ptm180 -138.01 -179.94 6.07 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.364 0.602 . . . . 0.0 112.357 -178.036 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.684 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -148.63 139.75 17.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.02 -179.431 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 407' ' ' GLY . . . . . 0.465 ' O ' ' CG ' ' B' ' 408' ' ' ASP . . . 56.29 16.29 14.06 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.15 -1.024 . . . . 0.0 110.737 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 408' ' ' ASP . . . . . 0.47 ' O ' ' OD1' ' B' ' 408' ' ' ASP . 1.9 p30 55.29 32.98 19.74 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.226 0.536 . . . . 0.0 110.336 -179.259 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -140.26 -26.64 0.23 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.517 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.684 ' HB ' HG23 ' B' ' 406' ' ' VAL . 44.6 m -121.24 110.92 16.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 117.143 0.471 . . . . 0.0 112.226 -179.234 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.484 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 60.1 t -86.53 111.63 21.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.336 178.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.815 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.3 OUTLIER -66.85 -37.74 85.03 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.248 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . -178.67 -143.44 5.25 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.452 -0.88 . . . . 0.0 112.408 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.792 ' OG1' HD11 ' B' ' 401' ' ' ILE . 11.5 t -176.1 170.1 2.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.557 0.218 . . . . 0.0 110.886 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.489 ' O ' HG13 ' B' ' 401' ' ' ILE . . . -161.18 146.43 12.29 Favored Glycine 0 C--O 1.226 -0.398 0 C-N-CA 120.348 -0.929 . . . . 0.0 112.804 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.845 HG22 ' HB ' ' B' ' 401' ' ' ILE . 54.7 t -121.34 155.05 25.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.813 0.339 . . . . 0.0 110.704 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.903 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -165.05 141.32 6.97 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.128 -1.034 . . . . 0.0 113.117 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.474 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -63.62 -41.54 98.27 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.722 0.296 . . . . 0.0 111.047 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.839 ' H ' HD11 ' B' ' 422' ' ' ILE . 8.6 p30 -102.47 29.68 5.09 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.509 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.684 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 47.81 -44.42 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 178.629 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.604 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -48.37 -48.95 36.31 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 119.116 0.871 . . . . 0.0 108.676 -179.398 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.903 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.52 -38.21 5.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.533 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.789 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -66.29 -43.2 86.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.493 178.163 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.48 -67.25 2.14 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.774 -0.727 . . . . 0.0 111.978 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.441 HG12 ' HG2' ' B' ' 421' ' ' LYS . 5.0 mm -50.25 -59.38 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.825 0.345 . . . . 0.0 111.205 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.586 ' HG3' ' N ' ' B' ' 427' ' ' ALA . 0.0 OUTLIER -49.36 -44.47 44.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.21 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.586 ' N ' ' HG3' ' B' ' 426' ' ' ARG . . . -47.4 -51.67 19.11 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.657 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -52.22 -50.9 61.04 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.828 179.15 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.496 ' HA ' ' CG ' ' B' ' 432' ' ' LEU . 40.2 mt-10 -56.22 -34.16 66.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.882 179.023 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.4 OUTLIER -59.91 -41.06 90.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.461 179.344 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.435 ' HB2' ' OH ' ' B' ' 387' ' ' TYR . . . -64.13 -42.55 96.77 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.234 0.54 . . . . 0.0 110.295 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.705 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.3 OUTLIER -84.26 7.03 20.54 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.482 179.328 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 10.0 mtt180 -94.86 14.3 21.95 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.084 0.468 . . . . 0.0 110.969 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.554 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 67.4 m-20 -125.73 78.27 1.73 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.821 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.553 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 8.6 ptpt -46.85 -53.55 11.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.047 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.553 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.3 mttt -55.65 -40.54 72.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 0.0 110.695 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.815 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.1 OUTLIER -71.91 -46.7 56.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.317 179.546 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.705 HD11 ' HA ' ' B' ' 432' ' ' LEU . 72.2 mt -57.95 -61.69 2.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.002 179.292 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -54.27 -33.23 58.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.906 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' B' ' 437' ' ' MET . 5.8 t80 -59.21 -38.57 80.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.493 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.625 ' CE1' HD21 ' B' ' 383' ' ' LEU . 53.2 m-85 -79.42 -27.2 41.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.112 179.029 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -59.66 -52.48 65.35 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.23 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.9 -47.17 86.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 177.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.519 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.7 OUTLIER -59.82 -17.01 32.76 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.15 178.591 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.502 ' O ' HG12 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -78.73 -48.41 14.97 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.343 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -75.22 -30.4 60.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.562 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.468 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -73.12 -79.99 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.239 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.519 HG23 ' O ' ' B' ' 444' ' ' GLN . 0.2 OUTLIER 28.22 94.8 0.04 OUTLIER Pre-proline 0 N--CA 1.463 0.225 0 CA-C-O 121.146 0.498 . . . . 0.0 111.489 -179.533 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 449' ' ' PRO . . . . . 0.423 ' O ' ' CB ' ' B' ' 450' ' ' ARG . 83.0 Cg_endo -79.23 -5.8 14.52 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.986 2.458 . . . . 0.0 112.72 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 450' ' ' ARG . . . . . 0.423 ' CB ' ' O ' ' B' ' 449' ' ' PRO . 0.0 OUTLIER 77.29 101.72 0.07 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.684 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 80.4 p -167.15 56.01 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.059 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -111.72 13.64 21.12 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.902 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.978 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.712 " O2'" ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.637 0 C3'-C2'-C1' 104.787 3.653 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.712 ' H8 ' " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.272 0 O4'-C1'-N19 111.206 3.006 . 0.035 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.505 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.495 0 C5'-C4'-C3' 111.02 -2.987 . 0.101 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.538 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.125 0 C5'-C4'-C3' 111.127 -2.915 . 0.074 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.632 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 P--O5' 1.613 2.026 0 O4'-C1'-N19 111.183 2.983 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.536 HO2' " C5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.365 0 C5'-C4'-C3' 111.118 -2.921 . 0.1 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.712 ' N4 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 P--O5' 1.611 1.827 0 C5'-C4'-C3' 111.139 -2.908 . 0.06 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.712 ' N4 ' ' N4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.563 0 C3'-C2'-C1' 104.554 3.393 . 0.195 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.978 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.168 0 O4'-C1'-N19 111.015 2.815 . 0.128 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.978 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.711 0 C3'-C2'-C1' 104.615 3.461 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.643 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.486 0 C5'-C4'-C3' 111.171 -2.886 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.791 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.803 0 C5'-C4'-C3' 111.152 -2.899 . 0.039 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.791 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.525 0 C3'-C2'-C1' 104.634 3.482 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.657 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.407 0 C5'-C4'-C3' 111.158 -2.895 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.875 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 1.96 0 C5'-C4'-C3' 110.934 -3.044 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.875 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.158 0 O4'-C1'-N19 111.275 3.075 OUTLIER-EPSILON 0.0 OUTLIER '7D dist 1b' 0.0 . . . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.776 ' N7 ' H5'' ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.95 0 C5'-C4'-C3' 110.701 -3.199 OUTLIER-EPSILON 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.697 ' P ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.926 0 C5'-C4'-C3' 111.093 -2.938 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.631 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.296 0 C5'-C4'-C3' 111.053 -2.964 . 0.344 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.777 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.807 0 O4'-C1'-N19 111.183 2.983 . 0.257 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.777 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.519 0 C5'-C4'-C3' 111.073 -2.951 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.689 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.875 0 O4'-C1'-N19 111.176 2.976 . 0.054 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.911 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.182 0 O4'-C1'-N19 111.217 3.017 . 0.018 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.911 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.438 0 C3'-C2'-C1' 104.431 3.257 . 0.234 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.434 ' C8 ' " H2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.308 0 O4'-C1'-N19 111.171 2.971 . 0.243 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.499 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.563 0 O4'-C1'-N19 111.094 2.894 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.971 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.081 0 O4'-C1'-N19 111.029 2.829 . 0.232 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.971 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.376 0 C3'-C2'-C1' 104.633 3.481 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.752 " H2'" " O4'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.286 0 O4'-C1'-N19 111.151 2.951 . 0.105 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.993 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.273 0 O4'-C1'-N19 111.46 3.26 . 0.126 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.993 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.876 0 C3'-C2'-C1' 104.574 3.415 . 0.071 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.447 " O5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.54 0 O4'-C1'-N19 111.161 2.961 . 0.175 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 364' ' ' GLY . . . . . 0.428 ' O ' ' HB3' ' B' ' 365' ' ' SER . . . . . . . . 0 N--CA 1.489 2.196 0 N-CA-C 112.374 -0.291 . . . . 0.0 112.374 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 365' ' ' SER . . . . . 0.456 ' O ' ' N ' ' B' ' 367' ' ' ASP . 20.7 t 70.76 25.34 4.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.916 0.389 . . . . 0.0 110.81 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.563 HD12 ' HB2' ' B' ' 369' ' ' ASN . 0.1 OUTLIER -36.12 -32.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.112 -179.904 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.663 ' O ' ' HB3' ' B' ' 370' ' ' ALA . 3.4 p30 -30.14 -37.7 0.02 OUTLIER 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.965 -179.029 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.542 ' HE3' ' N ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -54.37 -55.16 31.34 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.824 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.563 ' HB2' HD12 ' B' ' 366' ' ' LEU . 16.1 m120 -55.18 -37.74 67.44 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.318 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.663 ' HB3' ' O ' ' B' ' 367' ' ' ASP . . . -49.87 -78.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.746 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -41.68 -42.16 2.45 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.33 0.586 . . . . 0.0 109.939 179.606 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.59 ' HG3' ' N3 ' ' A' ' 18' ' ' ' A' . 13.7 ttp180 -55.64 -46.82 77.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.484 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.563 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.8 OUTLIER -57.29 -47.07 82.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.437 0.637 . . . . 0.0 110.49 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.755 ' N ' HD23 ' B' ' 374' ' ' LEU . 1.3 mt -51.63 -70.57 0.08 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.58 -179.029 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.449 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.3 m-85 -84.97 -42.08 15.27 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -177.642 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.9 OUTLIER -65.41 -29.3 69.98 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.835 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.563 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 4.3 mm? -110.94 -44.58 3.59 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.886 -179.423 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.549 HG13 ' CD2' ' B' ' 438' ' ' LEU . 0.9 OUTLIER -118.45 51.59 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.983 0.421 . . . . 0.0 111.432 -179.185 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.449 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -140.22 44.6 1.05 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.219 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.697 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 23.5 p90 -91.03 -45.93 8.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.678 0.275 . . . . 0.0 111.169 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.697 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 160.85 -168.0 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.266 0.555 . . . . 0.0 111.638 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 5.7 t 43.91 22.27 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.562 -0.745 . . . . 0.0 112.083 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.769 ' CD1' HD12 ' B' ' 385' ' ' LEU . 2.0 pt? -127.39 -0.49 6.3 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.485 ' HB2' ' HA2' ' B' ' 407' ' ' GLY . 1.3 mmt180 29.95 49.48 0.06 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.344 179.197 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.769 HD12 ' CD1' ' B' ' 383' ' ' LEU . 0.4 OUTLIER -59.94 129.76 43.39 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 121.073 0.464 . . . . 0.0 111.411 -179.505 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.581 ' O ' ' CD2' ' B' ' 386' ' ' HIS . 24.0 p-80 -167.79 108.88 0.59 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.154 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.511 ' HA ' ' HA ' ' B' ' 404' ' ' CYS . 2.8 m-85 -55.76 175.55 0.08 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.149 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.42 ' N ' ' O ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -157.54 101.87 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.743 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 31.4 m -77.18 106.32 8.83 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.661 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.723 HG23 HG23 ' B' ' 401' ' ' ILE . 28.4 m -112.42 150.43 14.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 0.0 110.678 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.654 ' HB3' HG22 ' B' ' 401' ' ' ILE . 8.2 tppt? 72.44 48.97 0.22 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.38 -179.395 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' B' ' 391' ' ' LYS . 2.2 mtmt -33.79 143.64 0.18 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.194 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.595 ' HB2' " O2'" ' A' ' 5' ' ' ' U' . 32.3 Cg_exo -58.23 179.98 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.954 2.436 . . . . 0.0 112.499 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.532 ' OG1' ' N ' ' B' ' 397' ' ' ASP . 0.1 OUTLIER -160.84 155.42 23.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.089 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 395' ' ' ALA . . . . . 0.634 ' HB1' " H1'" ' A' ' 30' ' ' ' C' . . . -59.24 -23.27 62.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.138 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 396' ' ' VAL . . . . . 0.844 HG12 " O2'" ' A' ' 30' ' ' ' C' . 2.8 m -123.96 13.44 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.234 0.54 . . . . 0.0 110.264 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.541 ' N ' ' HD3' ' B' ' 398' ' ' PRO . 0.8 OUTLIER -157.51 51.96 0.53 Allowed Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.468 179.645 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.541 ' HD3' ' N ' ' B' ' 397' ' ' ASP . 85.4 Cg_exo -46.65 -29.02 7.14 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.788 2.325 . . . . 0.0 112.396 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.498 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 20.8 p-10 -53.27 132.0 38.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.258 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -135.37 144.33 46.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.123 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 1.03 HD12 ' O ' ' B' ' 415' ' ' GLY . 0.6 OUTLIER -107.29 100.17 10.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-O 121.213 0.53 . . . . 0.0 111.223 -179.463 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.819 HG23 ' HB1' ' B' ' 423' ' ' ALA . 0.4 OUTLIER -72.39 163.2 4.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.048 179.716 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.513 ' HG2' ' N ' ' B' ' 404' ' ' CYS . 44.9 tt0 -148.9 158.49 44.21 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.79 ' O ' ' O ' ' B' ' 411' ' ' VAL . 24.3 t -132.49 130.72 40.83 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 178.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -129.79 126.99 39.43 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 123.697 0.623 . . . . 0.0 110.776 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.718 ' CG2' HD22 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -124.64 134.23 67.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.516 -179.287 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 407' ' ' GLY . . . . . 0.485 ' HA2' ' HB2' ' B' ' 384' ' ' ARG . . . 64.18 5.78 17.06 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.754 -0.736 . . . . 0.0 111.866 -179.273 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 66.48 68.61 0.43 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 163.87 -46.51 0.31 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.113 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.589 ' HB ' HG23 ' B' ' 406' ' ' VAL . 12.0 m -86.78 113.47 22.64 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.79 ' O ' ' O ' ' B' ' 404' ' ' CYS . 3.9 t -76.6 -60.93 1.91 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 -177.026 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.735 ' HG ' ' HE2' ' B' ' 437' ' ' MET . 0.1 OUTLIER 63.9 -39.2 0.21 Allowed 'General case' 0 C--N 1.315 -0.893 0 O-C-N 120.144 -1.598 . . . . 0.0 111.569 -178.51 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.587 ' HA2' ' HB3' ' B' ' 430' ' ' ASN . . . -112.97 127.5 7.97 Favored Glycine 0 C--N 1.35 1.326 0 C-N-CA 119.511 -1.328 . . . . 0.0 113.774 -179.54 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.523 ' N ' ' OD1' ' B' ' 430' ' ' ASN . 0.2 OUTLIER -165.84 63.16 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.709 0.29 . . . . 0.0 111.295 179.431 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 1.03 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -109.82 172.81 16.18 Favored Glycine 0 C--O 1.226 -0.368 0 C-N-CA 120.407 -0.901 . . . . 0.0 113.667 -178.411 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.463 HG22 ' H ' ' B' ' 417' ' ' GLY . 5.7 p -131.96 166.76 28.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.583 0.23 . . . . 0.0 110.628 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.75 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -172.81 116.25 0.6 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.092 -1.052 . . . . 0.0 113.184 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.489 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -43.69 -68.2 0.22 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.713 0.292 . . . . 0.0 110.386 179.324 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.893 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.2 OUTLIER -66.6 -20.57 66.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.039 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.893 HG23 ' O ' ' B' ' 419' ' ' ASN . 1.1 pp 102.29 -39.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 124.387 1.075 . . . . 0.0 111.37 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -49.63 -52.04 33.49 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.75 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.75 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.49 -33.27 2.96 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.519 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 177.417 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.819 ' HB1' HG23 ' B' ' 402' ' ' VAL . . . -74.22 -34.44 63.69 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.478 179.508 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -70.58 -56.24 7.71 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.149 -1.024 . . . . 0.0 111.152 178.613 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.574 ' O ' ' HB3' ' B' ' 428' ' ' ALA . 3.5 mp -63.77 -42.93 97.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.729 0.299 . . . . 0.0 110.446 179.168 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.576 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 17.8 tpt180 -53.51 -53.01 57.59 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.596 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -51.57 -40.23 59.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.574 ' HB3' ' O ' ' B' ' 425' ' ' ILE . . . -52.49 -74.21 0.04 OUTLIER 'General case' 0 C--O 1.236 0.393 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.508 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.551 ' HA ' ' HG ' ' B' ' 432' ' ' LEU . 3.3 mt-10 -43.04 -36.28 1.55 Allowed 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.587 ' HB3' ' HA2' ' B' ' 413' ' ' GLY . 0.3 OUTLIER -53.2 -36.86 61.42 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.263 178.954 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.568 ' O ' ' HE1' ' B' ' 437' ' ' MET . . . -83.51 -18.96 36.67 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 120.911 0.386 . . . . 0.0 110.782 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.596 HD22 ' HA ' ' B' ' 370' ' ' ALA . 0.8 OUTLIER -115.81 21.58 13.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.177 0.513 . . . . 0.0 109.965 178.938 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' B' ' 429' ' ' GLU . 38.0 mtt-85 -109.63 3.15 20.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.043 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.454 ' OD2' ' HA ' ' B' ' 412' ' ' LEU . 43.8 m-20 -106.37 77.07 1.18 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.303 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.539 ' HG3' ' N ' ' B' ' 436' ' ' LYS . 5.5 ptpp? -38.89 -48.08 1.51 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.558 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.539 ' N ' ' HG3' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -57.57 -51.56 68.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.043 -179.716 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.735 ' HE2' ' HG ' ' B' ' 412' ' ' LEU . 15.4 tmm? -61.43 -56.59 18.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.146 0.498 . . . . 0.0 110.0 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.549 ' CD2' HG13 ' B' ' 378' ' ' ILE . 60.4 mt -47.81 -64.77 0.7 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.882 178.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -54.92 -25.22 27.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.465 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.474 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -69.83 -39.08 76.67 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.362 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.555 ' HA ' ' HB2' ' B' ' 444' ' ' GLN . 32.4 m-85 -76.01 -51.97 11.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.174 179.118 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' B' ' 445' ' ' ARG . . . -44.45 -46.31 9.56 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -40.06 91.59 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.519 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.56 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -68.64 -7.18 30.77 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.49 178.917 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.589 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.1 OUTLIER -95.71 -40.08 9.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.411 179.98 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.87 -25.07 58.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.722 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . -76.15 -50.83 13.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.656 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.56 HG23 ' O ' ' B' ' 444' ' ' GLN . 8.1 pt -45.93 139.94 5.06 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.115 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -79.39 8.23 4.02 Favored 'Trans proline' 0 N--CA 1.465 -0.206 0 C-N-CA 122.93 2.42 . . . . 0.0 112.371 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 4.6 mtt-85 -123.34 61.39 1.05 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.013 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.29 -12.77 14.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.674 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.19 50.39 1.74 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.887 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 5.0 t . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.203 -0.904 . . . . 0.0 111.065 179.955 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.725 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.955 0 O4'-C1'-N19 111.539 3.339 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.725 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 1.979 0 C5'-C4'-C3' 111.382 -2.745 . 0.17 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.589 HO2' " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.604 0 C3'-C2'-C1' 104.662 3.513 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.589 " C5'" HO2' ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.2 0 O4'-C1'-N19 111.287 3.087 . 0.07 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.749 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 1.991 0 C5'-C4'-C3' 111.291 -2.806 . 0.056 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.509 " H5'" " O2'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.606 0 C5'-C4'-C3' 111.044 -2.97 . 0.139 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.479 " H2'" ' C6 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.008 0 O4'-C1'-N19 111.49 3.29 . 0.308 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.72 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.209 0 O4'-C1'-N19 110.917 2.717 . 0.237 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.72 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.383 0 O4'-C1'-N19 111.178 2.978 . 0.254 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.683 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.435 1.772 0 C5'-C4'-C3' 110.976 -3.016 . 0.047 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.616 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.477 0 O4'-C1'-N19 111.028 2.828 . 0.041 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.817 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.757 0 O4'-C1'-N19 111.064 2.864 . 0.103 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.817 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.663 0 C3'-C2'-C1' 104.55 3.389 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.686 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.544 0 O4'-C1'-N19 111.087 2.887 . 0.072 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.686 " O4'" " H2'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.428 -2.073 0 O4'-C1'-N19 111.113 2.913 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.665 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -1.989 0 O4'-C1'-N19 111.315 3.115 OUTLIER-EPSILON 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.596 " H2'" " O4'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -2.003 0 C5'-C4'-C3' 110.797 -3.135 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.63 ' N6 ' " O2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.883 0 C5'-C4'-C3' 111.206 -2.863 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.547 " O2'" " O4'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.113 0 O4'-C1'-N19 111.2 3.0 . 0.225 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.561 " O2'" ' HG2' ' B' ' 371' ' ' LYS . . . . . . . . 0 O4'--C1' 1.439 2.062 0 C5'-C4'-C3' 111.074 -2.95 . 0.109 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.527 " H2'" ' C6 ' ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 C3'-C2'-C1' 104.331 3.146 . 0.034 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.789 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.895 0 O4'-C1'-N19 111.096 2.896 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.677 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.276 0 O4'-C1'-N19 111.943 3.743 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.837 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.157 0 C5'-C4'-C3' 111.318 -2.788 . 0.062 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.497 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.109 0 O4'-C1'-N19 111.065 2.865 . 0.425 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.514 " O2'" " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.432 0 O4'-C1'-N19 111.135 2.935 . 0.355 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.554 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.132 0 O4'-C1'-N19 111.03 2.83 . 0.128 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.633 " O2'" " C5'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.267 0 C5'-C4'-C3' 111.072 -2.952 . 0.125 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.932 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.205 0 O4'-C1'-N19 111.041 2.841 . 0.199 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.932 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.366 0 O4'-C1'-N19 111.325 3.125 . 0.19 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.67 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.679 0 C3'-C2'-C1' 104.704 3.56 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.588 " O4'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.664 0 O4'-C1'-N19 111.336 3.136 . 0.051 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.222 0 N-CA-C 112.578 -0.209 . . . . 0.0 112.578 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 365' ' ' SER . . . . . 0.807 ' C ' HD23 ' B' ' 366' ' ' LEU . 58.0 p -170.8 52.0 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.835 0.35 . . . . 0.0 110.943 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.807 HD23 ' C ' ' B' ' 365' ' ' SER . 2.7 mt -116.16 -37.84 3.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.573 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.621 ' O ' ' HB3' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -20.59 -60.49 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.246 -179.047 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.575 ' CE ' ' HB3' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -48.14 -48.95 33.86 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.981 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.575 ' HB3' ' CE ' ' B' ' 368' ' ' MET . 0.5 OUTLIER -66.12 -25.72 67.12 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 178.786 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' B' ' 367' ' ' ASP . . . -58.99 -70.7 0.14 Allowed 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.561 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 0.1 OUTLIER -48.74 -33.27 9.91 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.317 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.548 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -58.88 -46.64 87.33 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.867 -1.061 . . . . 0.0 109.959 178.839 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.548 ' OE1' HD22 ' B' ' 438' ' ' LEU . 0.1 OUTLIER -63.02 -45.54 91.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.497 -179.785 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.836 HD22 ' HB3' ' B' ' 431' ' ' ALA . 0.4 OUTLIER -57.55 -69.52 0.16 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -178.118 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.416 ' CD2' " H5'" ' A' ' 20' ' ' ' A' . 8.6 m-30 -83.93 -33.97 24.57 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -177.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.8 ' C ' HD22 ' B' ' 377' ' ' LEU . 0.2 OUTLIER -81.97 -21.25 37.26 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.601 -0.44 . . . . 0.0 112.152 -178.932 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.822 ' O ' HD13 ' B' ' 378' ' ' ILE . 2.3 mm? -123.83 -6.59 7.93 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.603 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.822 HD13 ' O ' ' B' ' 377' ' ' LEU . 9.3 mm -145.6 -117.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 119.341 -0.361 . . . . 0.0 111.411 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.527 ' C ' ' O ' ' B' ' 378' ' ' ILE . . . -0.68 68.28 0.0 OUTLIER Glycine 0 C--N 1.346 1.096 0 N-CA-C 114.393 0.517 . . . . 0.0 114.393 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.596 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 0.1 OUTLIER -82.58 -78.07 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.02 0.438 . . . . 0.0 111.494 -179.764 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.596 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 164.36 50.28 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.091 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -147.34 6.55 0.86 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.623 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.66 ' H ' HD13 ' B' ' 383' ' ' LEU . 0.0 OUTLIER -152.42 18.51 0.63 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.179 0.514 . . . . 0.0 110.77 179.834 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 32.77 73.56 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.671 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.882 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.2 OUTLIER -59.52 114.17 2.57 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 177.791 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -122.2 102.46 8.15 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -176.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.778 ' OH ' ' HB2' ' B' ' 431' ' ' ALA . 13.2 m-85 -76.43 165.37 24.92 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 175.604 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.84 HG23 ' O ' ' B' ' 403' ' ' GLU . 0.2 OUTLIER -148.52 167.95 3.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 C-N-CA 120.131 -0.628 . . . . 0.0 111.003 178.95 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 7.7 m -130.54 118.12 20.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.92 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.926 HG23 HG23 ' B' ' 401' ' ' ILE . 20.3 m -130.03 153.4 38.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.799 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.504 ' HB3' HG22 ' B' ' 401' ' ' ILE . 0.1 OUTLIER 65.61 61.24 0.69 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.22 -179.779 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.19 139.19 56.08 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.472 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.577 ' HA ' ' HA ' ' B' ' 398' ' ' PRO . 11.0 Cg_endo -56.25 -172.89 0.04 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.574 2.183 . . . . 0.0 112.311 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.564 ' O ' ' HB2' ' B' ' 395' ' ' ALA . 54.9 p -157.02 -81.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.298 -0.41 . . . . 0.0 112.071 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 395' ' ' ALA . . . . . 0.564 ' HB2' ' O ' ' B' ' 394' ' ' THR . . . 167.76 -25.3 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 -179.549 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -116.22 -2.51 10.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.556 0.693 . . . . 0.0 110.16 178.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.438 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 1.3 m-20 179.06 56.39 0.06 OUTLIER Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.638 179.604 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.577 ' HA ' ' HA ' ' B' ' 393' ' ' PRO . 10.4 Cg_endo -54.57 -77.31 0.02 OUTLIER 'Trans proline' 0 CA--C 1.519 -0.251 0 C-N-CA 123.252 2.635 . . . . 0.0 112.884 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.55 ' O ' ' O ' ' B' ' 398' ' ' PRO . 0.4 OUTLIER 44.84 115.43 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.142 -179.542 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 400' ' ' SER . . . . . 0.477 ' HB3' ' HA ' ' B' ' 420' ' ' ILE . 2.0 t -113.21 117.33 31.58 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.733 179.527 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.926 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -108.04 106.61 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 CA-C-O 121.305 0.574 . . . . 0.0 110.663 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.807 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.3 OUTLIER -77.96 158.58 4.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.099 179.756 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.84 ' O ' HG23 ' B' ' 388' ' ' VAL . 7.2 tp10 -128.78 89.48 2.89 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.191 178.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.728 ' O ' ' O ' ' B' ' 411' ' ' VAL . 0.4 OUTLIER -82.42 114.83 21.13 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 178.076 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.528 ' HA ' ' O ' ' B' ' 411' ' ' VAL . 17.5 ptt85 -155.8 169.42 24.42 Favored 'General case' 0 C--O 1.226 -0.154 0 O-C-N 124.224 0.952 . . . . 0.0 109.744 -178.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 1.051 HG13 HD21 ' B' ' 412' ' ' LEU . 23.7 m -127.27 126.43 67.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.829 0.347 . . . . 0.0 111.772 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -35.05 -33.9 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 CA-C-N 115.709 -0.678 . . . . 0.0 113.314 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 408' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' B' ' 406' ' ' VAL . 15.1 t0 -59.47 -29.19 67.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.975 0.417 . . . . 0.0 110.675 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 118.03 47.26 0.44 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 121.038 -0.601 . . . . 0.0 111.769 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.625 ' HB ' HG22 ' B' ' 406' ' ' VAL . 0.2 OUTLIER -142.45 112.68 7.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.727 0.298 . . . . 0.0 111.402 -179.241 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.728 ' O ' ' O ' ' B' ' 404' ' ' CYS . 20.8 t -59.17 -63.7 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 1.051 HD21 HG13 ' B' ' 406' ' ' VAL . 0.0 OUTLIER 86.09 -42.55 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 O-C-N 121.485 -0.759 . . . . 0.0 109.31 -178.336 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.518 ' O ' ' CB ' ' B' ' 404' ' ' CYS . . . 167.46 175.15 37.15 Favored Glycine 0 C--N 1.339 0.736 0 C-N-CA 119.61 -1.281 . . . . 0.0 113.742 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.49 ' OG1' ' N ' ' B' ' 415' ' ' GLY . 0.0 OUTLIER -142.63 -177.64 5.39 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.481 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.784 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -158.07 117.34 0.77 Allowed Glycine 0 C--O 1.223 -0.555 0 C-N-CA 118.742 -1.694 . . . . 0.0 114.273 -179.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.462 ' HA ' ' O ' ' B' ' 400' ' ' SER . 38.3 t -107.45 145.07 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 178.34 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.595 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -166.91 145.94 10.36 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 119.531 -1.319 . . . . 0.0 113.467 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 418' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -53.31 36.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 110.653 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.901 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.5 OUTLIER -79.73 -21.83 44.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.24 179.512 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.901 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.8 OUTLIER 99.07 -41.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 C-N-CA 124.038 0.935 . . . . 0.0 111.429 -179.215 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.592 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -50.32 -42.2 52.39 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.436 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.63 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -56.72 -37.23 51.97 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.656 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 177.717 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.807 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -71.42 -31.55 67.37 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.145 179.061 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -71.39 -67.14 1.95 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.199 -1.001 . . . . 0.0 111.168 178.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.587 HD13 ' HG2' ' B' ' 421' ' ' LYS . 2.9 mp -51.66 -46.65 38.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 121.068 0.461 . . . . 0.0 110.207 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.566 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.4 tpt180 -54.25 -43.56 71.03 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.217 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.47 ' HB1' ' HE2' ' B' ' 387' ' ' TYR . . . -52.62 -49.99 63.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.175 179.402 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' B' ' 431' ' ' ALA . . . -54.75 -72.2 0.07 Allowed 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.22 0.533 . . . . 0.0 110.11 179.253 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.522 ' HG3' ' HB2' ' B' ' 370' ' ' ALA . 2.8 mt-10 -45.31 -28.02 0.76 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.936 179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.53 ' ND2' ' HG3' ' B' ' 426' ' ' ARG . 0.6 OUTLIER -68.02 -34.12 75.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.333 179.4 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.836 ' HB3' HD22 ' B' ' 374' ' ' LEU . . . -65.24 -47.46 76.7 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.308 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.834 ' CA ' HD11 ' B' ' 438' ' ' LEU . 0.7 OUTLIER -88.28 20.23 3.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.565 179.667 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 8.4 ttt-85 -90.02 1.02 56.78 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.039 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.541 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 95.2 m-20 -114.69 76.09 0.97 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.67 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.449 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -39.33 -45.38 1.43 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 -179.716 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.449 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.2 mmpt? -63.36 -53.48 51.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.922 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.573 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -60.14 -37.36 79.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.122 0.487 . . . . 0.0 109.97 179.501 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.834 HD11 ' CA ' ' B' ' 432' ' ' LEU . 58.6 mt -66.53 -55.62 14.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.213 179.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -64.62 -25.9 68.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.821 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.517 ' CE2' ' CE1' ' B' ' 441' ' ' TYR . 0.2 OUTLIER -69.4 -41.47 76.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.17 0.51 . . . . 0.0 109.663 179.34 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.542 ' CD1' ' OH ' ' B' ' 380' ' ' TYR . 16.0 m-85 -71.99 -39.87 68.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.707 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -54.79 -40.05 69.06 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 443' ' ' LYS . . . . . 0.453 ' O ' ' HE3' ' B' ' 443' ' ' LYS . 0.1 OUTLIER -69.94 -53.91 15.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.501 179.067 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.587 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -53.55 -30.38 41.55 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.182 0.515 . . . . 0.0 110.004 179.653 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.82 ' HD2' HD11 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -66.72 -53.74 30.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.681 179.697 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -61.52 -24.41 66.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.251 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.14 -53.55 5.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.191 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.82 HD11 ' HD2' ' B' ' 445' ' ' ARG . 15.4 pt -42.11 113.59 1.24 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.151 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -76.34 -166.69 0.39 Allowed 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 122.645 2.23 . . . . 0.0 111.994 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 450' ' ' ARG . . . . . 0.518 ' NH1' ' HB2' ' B' ' 450' ' ' ARG . 0.0 OUTLIER -142.57 104.32 4.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.939 0.399 . . . . 0.0 110.992 179.962 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -151.4 137.78 18.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.611 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.08 162.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.583 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 76.7 p . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.242 -0.885 . . . . 0.0 110.799 179.985 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.507 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.206 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.448 ' C ' ' O ' ' B' ' 367' ' ' ASP . 3.0 ttp -32.49 -52.21 0.29 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.507 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 32.0 m-20 -58.65 -49.79 76.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.224 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.61 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -54.86 -79.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.275 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.479 ' HD2' ' HB2' ' B' ' 367' ' ' ASP . 0.2 OUTLIER -29.33 -45.15 0.04 OUTLIER 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.031 0.443 . . . . 0.0 111.016 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.525 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -61.64 -61.64 2.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.323 179.551 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.668 ' HB3' HD22 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -40.93 -34.55 0.42 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.221 0.534 . . . . 0.0 110.137 179.309 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.648 HD23 ' N ' ' B' ' 374' ' ' LEU . 2.6 mt -68.29 -80.9 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.211 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.88 27.79 0.85 Allowed 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -178.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.525 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 1.1 p -135.92 -31.57 0.92 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.241 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.762 ' O ' HD13 ' B' ' 378' ' ' ILE . 1.1 mm? -109.39 -27.85 9.26 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.762 HD13 ' O ' ' B' ' 377' ' ' LEU . 19.0 mm -129.5 -62.5 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.804 -179.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.847 ' HA2' HD12 ' B' ' 383' ' ' LEU . . . -32.64 102.72 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.732 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.529 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 10.1 p90 -115.04 177.73 4.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.888 0.375 . . . . 0.0 110.831 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' B' ' 382' ' ' SER . . . -65.99 118.14 9.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.213 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.464 ' HB3' ' O ' ' B' ' 381' ' ' ALA . 8.4 t 79.13 45.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.224 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.847 HD12 ' HA2' ' B' ' 379' ' ' GLY . 0.1 OUTLIER -95.39 -42.16 8.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.809 0.338 . . . . 0.0 110.706 179.675 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.513 ' CB ' ' O ' ' B' ' 383' ' ' LEU . 3.8 tpm_? 84.56 -6.16 0.99 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.106 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.921 ' HA ' HG12 ' B' ' 406' ' ' VAL . 4.5 tt -36.02 129.5 0.66 Allowed 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.778 0.323 . . . . 0.0 110.583 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.445 ' N ' HD23 ' B' ' 385' ' ' LEU . 3.9 p-80 -161.22 147.37 14.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.647 0.737 . . . . 0.0 112.862 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.494 ' OH ' ' HA ' ' B' ' 428' ' ' ALA . 11.9 m-85 -105.12 141.95 35.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.97 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -121.72 123.29 69.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.091 0.472 . . . . 0.0 111.289 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.15 130.41 38.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.629 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.669 HG23 ' CG2' ' B' ' 401' ' ' ILE . 28.0 m -141.36 144.9 25.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.964 0.411 . . . . 0.0 110.915 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.566 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 7.9 tptt 95.68 56.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.531 -179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.451 ' HA ' ' HD2' ' B' ' 393' ' ' PRO . 4.2 mmpt? -31.21 107.41 0.25 Allowed Pre-proline 0 N--CA 1.462 0.154 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.206 -179.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.489 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 4.3 Cg_exo -44.98 159.53 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.799 2.333 . . . . 0.0 113.353 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 16.6 p -128.12 158.27 38.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.972 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -86.28 13.83 7.45 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.597 179.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 3.0 m -136.96 14.05 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.082 177.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.4 ' H ' ' HD3' ' B' ' 398' ' ' PRO . 0.4 OUTLIER 166.45 61.56 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 114.496 -1.229 . . . . 0.0 108.797 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.489 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 96.4 Cg_exo -42.8 -32.18 2.45 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.225 2.617 . . . . 0.0 113.086 -179.034 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.608 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.8 OUTLIER -30.67 127.21 0.15 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.022 -178.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 47.7 t -136.55 166.92 22.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.848 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.669 ' CG2' HG23 ' B' ' 390' ' ' VAL . 15.3 tt -122.51 161.98 22.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.105 0.478 . . . . 0.0 111.495 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.754 ' O ' HG22 ' B' ' 414' ' ' THR . 0.1 OUTLIER -128.68 143.76 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.943 -179.624 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -110.69 125.78 53.84 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.742 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 41.3 t -106.18 107.21 18.1 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.698 ' HB3' HG22 ' B' ' 411' ' ' VAL . 0.0 OUTLIER -147.65 -171.31 3.78 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.196 0.522 . . . . 0.0 111.536 -179.131 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.921 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.1 OUTLIER -135.85 147.5 28.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.157 -179.395 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . 0.456 ' HA3' ' HG2' ' B' ' 384' ' ' ARG . . . -35.34 -28.8 0.01 OUTLIER Glycine 0 C--N 1.332 0.311 0 CA-C-N 115.488 -0.778 . . . . 0.0 113.62 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . 0.463 ' N ' ' O ' ' B' ' 406' ' ' VAL . 59.3 m-20 -70.31 -3.17 15.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.877 0.37 . . . . 0.0 111.099 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 82.26 33.06 26.9 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.783 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.535 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 19.3 m -116.18 118.38 32.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.587 0.232 . . . . 0.0 111.375 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.698 HG22 ' HB3' ' B' ' 405' ' ' ARG . 70.9 t -92.32 111.9 25.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.156 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.535 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.5 OUTLIER -67.37 -36.21 80.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.364 -0.38 . . . . 0.0 109.978 179.164 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.45 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . -175.29 -152.57 9.45 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.518 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.754 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.1 OUTLIER -159.92 174.17 14.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.475 0.179 . . . . 0.0 110.701 -179.84 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.678 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -169.03 128.51 1.7 Allowed Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.133 -1.032 . . . . 0.0 112.877 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 7.1 p -123.49 155.59 29.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.853 0.358 . . . . 0.0 110.411 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.983 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -164.43 169.22 39.13 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.554 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -79.98 -39.95 29.0 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 117.312 0.556 . . . . 0.0 111.532 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.854 ' OD1' HD11 ' B' ' 422' ' ' ILE . 3.0 p-10 -101.99 31.75 3.77 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.763 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.79 -46.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.635 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -44.42 -55.17 5.23 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 118.796 0.725 . . . . 0.0 109.806 -179.474 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.983 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -42.83 -34.26 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.571 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.194 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.763 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -68.61 -44.81 73.48 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.184 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -60.03 -62.98 5.47 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.181 -1.009 . . . . 0.0 111.676 179.158 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.684 ' H ' HD12 ' B' ' 425' ' ' ILE . 4.4 mp -56.73 -42.24 76.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.91 0.386 . . . . 0.0 110.393 179.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.579 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -56.02 -43.57 77.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.126 179.434 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.591 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -56.41 -50.51 71.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.337 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.61 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -55.08 -59.65 4.46 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.665 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.468 ' O ' ' HB3' ' B' ' 433' ' ' ARG . 2.9 mt-10 -50.07 -29.87 9.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.124 0.488 . . . . 0.0 109.838 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.514 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 0.8 OUTLIER -67.79 -38.12 82.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.398 179.5 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.742 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -62.69 -41.79 99.29 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.165 0.507 . . . . 0.0 110.204 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.668 HD22 ' HB3' ' B' ' 373' ' ' GLN . 0.1 OUTLIER -87.26 5.94 35.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.362 179.124 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.514 ' CG ' ' O ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -89.4 11.81 18.14 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.109 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.569 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 14.4 m-20 -125.81 81.38 1.98 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.521 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 12.3 ptpt -46.93 -49.35 20.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.427 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.521 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.2 mmmm -61.22 -46.12 91.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.742 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.569 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 18.9 tmm? -63.24 -45.92 89.31 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.003 0.43 . . . . 0.0 110.076 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.504 HD22 HE22 ' B' ' 373' ' ' GLN . 84.3 mt -57.37 -62.42 1.78 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.915 179.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -54.03 -32.28 53.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.014 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.475 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.7 OUTLIER -57.86 -43.3 85.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.118 179.661 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -73.81 -28.31 61.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.568 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.57 -51.37 67.34 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 11.0 ttpp -63.31 -48.14 79.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.577 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -50.11 -44.93 52.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.81 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.529 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.361 179.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.855 0.359 . . . . 0.0 110.495 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.491 ' O ' ' HB2' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -40.76 -42.67 1.82 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.587 179.662 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -63.84 -36.92 85.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.521 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.645 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -68.54 -74.26 0.13 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.605 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.434 ' C ' ' O ' ' B' ' 370' ' ' ALA . 0.1 OUTLIER -37.11 -44.08 0.53 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.076 0.465 . . . . 0.0 110.274 179.67 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.554 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.6 OUTLIER -64.31 -42.65 96.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.764 179.695 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.651 ' NE2' HD22 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -57.34 -42.83 82.72 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.174 0.512 . . . . 0.0 110.563 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.569 ' CD2' HD12 ' B' ' 432' ' ' LEU . 0.4 OUTLIER -64.69 -72.79 0.14 Allowed 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -178.62 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 4.6 m-30 -79.54 -25.02 41.78 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -177.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -91.08 -31.71 16.15 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.872 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.941 ' O ' HD13 ' B' ' 378' ' ' ILE . 4.6 mm? -110.85 -13.63 14.11 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.711 -0.396 . . . . 0.0 112.056 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.941 HD13 ' O ' ' B' ' 377' ' ' LEU . 12.5 mm -141.99 -121.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.678 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.516 ' C ' ' O ' ' B' ' 378' ' ' ILE . . . -13.9 82.2 0.0 OUTLIER Glycine 0 C--N 1.343 0.971 0 N-CA-C 114.13 0.412 . . . . 0.0 114.13 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.669 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 0.6 OUTLIER -74.27 -58.97 2.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.764 0.316 . . . . 0.0 110.317 179.591 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.669 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 155.28 34.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.481 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.98 16.95 0.67 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.657 0.265 . . . . 0.0 111.188 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.929 HD13 ' HB2' ' B' ' 385' ' ' LEU . 0.2 OUTLIER -123.87 26.16 7.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.975 0.417 . . . . 0.0 110.635 179.565 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.474 ' HG3' ' HA3' ' B' ' 407' ' ' GLY . 0.0 OUTLIER 36.79 41.28 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.15 179.858 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.929 ' HB2' HD13 ' B' ' 383' ' ' LEU . 1.1 tt -69.2 132.62 46.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.978 0.418 . . . . 0.0 110.752 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 -169.05 135.25 1.7 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.298 0.57 . . . . 0.0 112.194 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.609 ' OH ' ' HB2' ' B' ' 431' ' ' ALA . 2.3 m-85 -84.41 178.55 7.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.325 -0.852 . . . . 0.0 108.741 178.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.656 HG23 ' O ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -153.6 108.57 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.297 0.57 . . . . 0.0 112.153 178.525 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.2 m -72.18 100.04 2.48 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.269 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.809 HG23 HG23 ' B' ' 401' ' ' ILE . 32.6 m -107.96 148.66 11.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.234 0.54 . . . . 0.0 111.116 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.464 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 15.1 tptt 80.82 55.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.406 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.443 ' C ' ' O ' ' B' ' 391' ' ' LYS . 3.0 mmpt? -33.88 131.33 0.4 Allowed Pre-proline 0 C--N 1.332 -0.152 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.555 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.537 ' HA ' ' O ' ' B' ' 398' ' ' PRO . 52.2 Cg_exo -53.74 174.42 0.15 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.554 2.169 . . . . 0.0 112.912 -178.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.527 ' OG1' ' N ' ' B' ' 397' ' ' ASP . 3.8 p -140.99 151.4 44.11 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.512 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -76.76 -5.37 47.86 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.137 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . 0.416 ' O ' ' OD1' ' B' ' 397' ' ' ASP . 35.7 m -125.39 9.46 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.485 0.659 . . . . 0.0 110.073 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.527 ' N ' ' OG1' ' B' ' 394' ' ' THR . 7.5 m-20 179.18 63.19 0.11 Allowed Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 114.918 -1.037 . . . . 0.0 109.687 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.537 ' O ' ' HA ' ' B' ' 393' ' ' PRO . 39.7 Cg_exo -31.27 -65.99 0.08 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.333 2.689 . . . . 0.0 112.618 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.513 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 14.3 m120 7.71 116.6 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . 0.485 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 0.3 OUTLIER -134.14 149.74 51.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.577 178.503 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.809 HG23 HG23 ' B' ' 390' ' ' VAL . 1.3 tp -127.36 130.09 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 121.324 0.583 . . . . 0.0 112.478 -178.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.73 ' O ' HG22 ' B' ' 414' ' ' THR . 0.7 OUTLIER -91.47 161.44 2.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.182 179.501 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.656 ' O ' HG23 ' B' ' 388' ' ' VAL . 0.8 OUTLIER -138.58 96.83 3.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.97 0.414 . . . . 0.0 111.239 179.348 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -77.83 112.68 14.95 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.69 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.684 ' HD3' HG22 ' B' ' 411' ' ' VAL . 35.9 ttp180 -147.05 161.84 40.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.138 0.494 . . . . 0.0 111.551 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.681 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -130.56 128.8 63.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.149 -179.184 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . 0.474 ' HA3' ' HG3' ' B' ' 384' ' ' ARG . . . -30.03 -34.48 0.01 OUTLIER Glycine 0 C--N 1.334 0.442 0 C-N-CA 121.284 -0.484 . . . . 0.0 113.686 -179.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . 0.514 ' N ' ' O ' ' B' ' 406' ' ' VAL . 6.5 m-20 -55.19 -18.51 6.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.059 0.457 . . . . 0.0 110.386 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 99.35 32.35 5.81 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.834 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.571 ' HB ' HG23 ' B' ' 406' ' ' VAL . 40.0 m -122.19 121.38 36.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.964 0.412 . . . . 0.0 111.53 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.684 HG22 ' HD3' ' B' ' 405' ' ' ARG . 38.6 t -90.29 84.67 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.439 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.796 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -43.06 -23.32 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.34 -179.598 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.445 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 161.61 -174.01 38.07 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.013 -1.089 . . . . 0.0 113.044 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.73 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -143.08 171.73 13.67 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.714 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -160.7 144.06 9.58 Favored Glycine 0 C--O 1.221 -0.692 0 C-N-CA 119.779 -1.2 . . . . 0.0 113.16 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 5.0 p -132.86 155.01 40.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.513 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -170.3 151.65 17.03 Favored Glycine 0 N--CA 1.453 -0.187 0 C-N-CA 120.02 -1.086 . . . . 0.0 113.293 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.514 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 2.3 mtm-85 -70.51 -55.26 9.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.907 0.384 . . . . 0.0 110.499 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.879 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.2 OUTLIER -75.63 -21.65 57.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.888 179.217 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.879 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 98.14 -41.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.113 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.144 -179.291 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.596 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -52.95 -40.41 63.64 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.579 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.688 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -59.14 -35.92 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.748 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 177.355 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.644 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -68.73 -36.65 78.68 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.016 178.14 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.76 -67.14 2.15 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.952 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.41 ' O ' ' HB3' ' B' ' 428' ' ' ALA . 2.4 mp -53.81 -48.3 61.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.598 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -50.08 -49.57 51.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.178 179.402 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.539 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -49.68 -44.63 48.01 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.144 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.677 ' O ' HD13 ' B' ' 432' ' ' LEU . . . -57.35 -68.07 0.27 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.552 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.407 ' HA ' HD11 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -43.6 -25.6 0.18 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.668 179.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.445 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 11.3 m-80 -79.6 -32.88 41.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.712 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.609 ' HB2' ' OH ' ' B' ' 387' ' ' TYR . . . -65.52 -40.99 93.6 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 120.87 0.367 . . . . 0.0 110.517 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.902 ' O ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -95.85 25.86 4.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.479 0.657 . . . . 0.0 109.905 179.032 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 6.1 ttt180 -96.38 -8.83 31.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.087 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -101.16 96.68 7.37 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.788 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.523 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 4.4 ptpp? -51.78 -51.11 58.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.259 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.523 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 8.6 mmtt -56.25 -50.12 72.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.98 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.796 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -66.61 -43.49 84.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.93 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.902 HD11 ' O ' ' B' ' 432' ' ' LEU . 35.8 mt -61.72 -55.73 27.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.22 0.534 . . . . 0.0 111.103 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . 0.507 ' O ' ' HG3' ' B' ' 443' ' ' LYS . 20.2 t70 -65.39 -27.35 68.49 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.169 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -59.79 -47.43 85.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.949 -0.568 . . . . 0.0 109.994 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.626 ' HB2' HG23 ' B' ' 378' ' ' ILE . 60.8 m-85 -75.02 -35.43 61.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.592 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -48.57 -51.85 25.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.947 0.403 . . . . 0.0 110.075 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' B' ' 439' ' ' ASP . 0.0 OUTLIER -72.65 -46.93 51.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.873 179.035 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.482 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -53.69 -19.18 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.697 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.564 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.808 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.9 OUTLIER . . . . . 0 C--O 1.233 0.201 0 CA-C-O 120.888 0.375 . . . . 0.0 110.12 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.511 ' HA ' ' HD2' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -34.59 -45.56 0.25 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.429 179.772 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -59.39 -48.01 83.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.509 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 1.025 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -62.33 -75.28 0.08 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.581 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -31.58 -41.92 0.05 OUTLIER 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.105 -179.673 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.58 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.4 OUTLIER -65.44 -45.59 83.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.346 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.608 ' OE1' HD13 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -58.91 -39.58 81.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.177 0.513 . . . . 0.0 111.153 -179.792 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.48 HD11 ' OH ' ' B' ' 387' ' ' TYR . 1.3 mm? -67.66 -71.09 0.22 Allowed 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . 0.505 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-30 -87.37 5.88 36.45 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -177.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.58 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -122.56 -20.35 6.04 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.103 179.321 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.772 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.8 OUTLIER -116.15 -27.42 6.9 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.453 179.75 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.772 HD13 ' O ' ' B' ' 377' ' ' LEU . 3.7 mm -142.07 33.58 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.112 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.505 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -122.28 86.27 0.39 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.72 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.535 ' CD2' ' HD3' ' B' ' 445' ' ' ARG . 5.1 p90 -97.86 167.63 10.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.726 0.298 . . . . 0.0 110.491 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.55 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -66.9 114.86 6.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.916 0.389 . . . . 0.0 111.714 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.55 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.4 p 90.42 44.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.881 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.507 ' CD1' ' O ' ' B' ' 378' ' ' ILE . 1.0 OUTLIER -92.61 -40.41 10.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.939 0.4 . . . . 0.0 110.684 179.657 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.446 ' CB ' ' O ' ' B' ' 383' ' ' LEU . 2.0 tpt180 81.78 -8.95 1.28 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.106 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.815 ' HA ' HG12 ' B' ' 406' ' ' VAL . 7.9 tt -40.83 136.02 1.53 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.493 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.523 ' N ' HD23 ' B' ' 385' ' ' LEU . 9.1 p-80 -164.11 148.85 10.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.541 0.686 . . . . 0.0 112.577 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.514 ' CD2' ' HB1' ' B' ' 427' ' ' ALA . 2.8 m-85 -101.23 141.95 33.37 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.989 179.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.666 HG23 ' HB2' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -121.25 120.02 60.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.16 0.505 . . . . 0.0 111.324 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 10.6 m -76.27 134.38 39.8 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.77 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.983 HG23 HG23 ' B' ' 401' ' ' ILE . 20.8 m -141.14 157.78 22.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.874 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.636 ' HB2' HG22 ' B' ' 401' ' ' ILE . 4.5 tmtt? 85.99 62.6 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.21 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.461 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER -29.47 125.92 0.26 Allowed Pre-proline 0 C--N 1.334 -0.075 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.001 -179.492 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.478 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 8.1 Cg_exo -70.39 161.16 47.02 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.559 2.173 . . . . 0.0 113.023 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.439 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 1.6 p -135.78 165.49 25.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.92 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -90.97 19.86 5.32 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.361 0.6 . . . . 0.0 110.478 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 14.5 m -139.78 14.19 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.329 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.478 ' H ' ' CD ' ' B' ' 398' ' ' PRO . 4.6 m-20 163.82 54.63 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.839 -179.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.478 ' CD ' ' H ' ' B' ' 397' ' ' ASP . 5.2 Cg_exo -40.15 -25.56 0.17 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.509 2.806 . . . . 0.0 112.818 -179.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 52.5 p30 -30.99 148.41 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.328 0.585 . . . . 0.0 112.082 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -155.26 155.85 34.53 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.281 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.983 HG23 HG23 ' B' ' 390' ' ' VAL . 0.2 OUTLIER -108.49 152.8 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.448 179.707 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.702 HG23 ' HB1' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -123.48 142.69 39.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.736 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.666 ' HB2' HG23 ' B' ' 388' ' ' VAL . 1.8 mt-10 -108.29 128.4 54.71 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 179.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.545 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.8 OUTLIER -108.09 109.57 21.04 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.099 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.73 ' HB3' HG22 ' B' ' 411' ' ' VAL . 0.0 OUTLIER -145.59 -156.68 0.73 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.181 0.515 . . . . 0.0 111.704 -178.894 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.815 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -151.86 143.34 15.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.271 -179.443 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -38.23 -27.56 0.04 OUTLIER Glycine 0 C--N 1.332 0.353 0 CA-C-N 115.612 -0.722 . . . . 0.0 113.361 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . 0.575 ' OD1' HG23 ' B' ' 406' ' ' VAL . 47.0 p30 -69.51 -4.71 20.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.812 0.339 . . . . 0.0 110.878 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 85.04 39.33 8.61 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.156 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.564 ' HB ' HG23 ' B' ' 406' ' ' VAL . 12.8 m -127.31 118.29 23.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.724 0.297 . . . . 0.0 111.659 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.73 HG22 ' HB3' ' B' ' 405' ' ' ARG . 52.1 t -92.96 112.1 25.67 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.807 179.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.613 ' HG ' ' HE1' ' B' ' 437' ' ' MET . 0.5 OUTLIER -67.24 -37.64 83.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.383 179.418 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.49 ' O ' ' HB ' ' B' ' 414' ' ' THR . . . -174.35 -150.66 7.82 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.505 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.49 ' HB ' ' O ' ' B' ' 413' ' ' GLY . 13.2 t 176.09 155.3 0.21 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.694 0.283 . . . . 0.0 111.028 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.502 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -150.52 -177.18 24.2 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.461 -0.876 . . . . 0.0 112.796 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 2.2 p -153.16 161.55 2.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.796 0.331 . . . . 0.0 110.926 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.981 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -166.21 171.63 41.31 Favored Glycine 0 C--O 1.225 -0.454 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.933 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.443 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.0 OUTLIER -83.64 -39.92 19.64 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 117.067 0.434 . . . . 0.0 111.362 -179.857 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.85 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -104.44 31.81 4.43 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.048 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.56 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.33 -45.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 178.875 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.631 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -45.9 -49.35 15.67 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.296 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.981 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.49 -40.62 7.08 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.62 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.935 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.702 ' HB1' HG23 ' B' ' 402' ' ' VAL . . . -65.77 -40.42 91.99 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.485 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.92 -67.91 1.89 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.552 -0.832 . . . . 0.0 111.227 178.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.515 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 1.1 mp -52.52 -47.27 48.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.602 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 11.4 tpt180 -51.37 -47.95 62.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.72 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.622 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -47.36 -49.52 24.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.46 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 1.025 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -56.34 -57.66 11.31 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.657 ' HA ' HD21 ' B' ' 432' ' ' LEU . 0.5 OUTLIER -49.36 -20.05 0.61 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.712 179.257 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.504 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 4.3 m-80 -83.86 -36.91 23.08 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.916 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.4 ' HB3' HD21 ' B' ' 374' ' ' LEU . . . -65.42 -40.69 93.65 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.857 0.36 . . . . 0.0 111.167 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.8 HD13 ' O ' ' B' ' 428' ' ' ALA . 0.0 OUTLIER -89.57 9.41 26.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.98 179.89 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.528 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 23.8 ttm180 -89.97 3.74 52.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.077 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.456 ' HB3' ' CB ' ' B' ' 437' ' ' MET . 48.3 m-20 -115.09 87.34 2.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.896 0.379 . . . . 0.0 111.116 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.531 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -50.19 -51.23 45.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.987 179.506 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.531 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -57.94 -43.84 86.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.602 179.61 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.613 ' HE1' ' HG ' ' B' ' 412' ' ' LEU . 9.2 tmm? -66.48 -49.67 65.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.134 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.608 HD13 ' OE1' ' B' ' 373' ' ' GLN . 47.4 mt -54.91 -63.31 1.19 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.042 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -56.22 -31.1 63.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.938 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.3 OUTLIER -59.22 -38.95 81.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.105 179.723 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.436 ' O ' ' HB2' ' B' ' 445' ' ' ARG . 43.3 m-85 -82.62 -21.09 35.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.782 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -67.47 -52.48 38.77 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -61.69 -45.0 95.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.502 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.63 -52.96 63.28 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.941 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.535 ' HD3' ' CD2' ' B' ' 380' ' ' TYR . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.269 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.718 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.589 ' OD1' HD12 ' B' ' 425' ' ' ILE . 7.3 t0 . . . . . 0 CA--C 1.521 -0.153 0 CA-C-O 120.713 0.292 . . . . 0.0 110.464 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.443 ' C ' ' O ' ' B' ' 367' ' ' ASP . 0.9 OUTLIER -33.49 -52.57 0.39 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.72 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . 0.42 ' OD1' ' CE ' ' B' ' 368' ' ' MET . 66.2 m-20 -60.0 -42.73 94.88 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.401 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.836 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -61.35 -78.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.796 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -32.03 -44.75 0.09 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.834 -179.606 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.506 ' O ' ' HB2' ' B' ' 376' ' ' SER . 0.0 OUTLIER -58.62 -58.93 6.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.355 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.922 ' OE1' HD23 ' B' ' 377' ' ' LEU . 0.0 OUTLIER -47.28 -56.13 7.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.331 0.586 . . . . 0.0 110.974 179.814 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.732 HD23 ' N ' ' B' ' 374' ' ' LEU . 2.0 mt -46.39 -69.76 0.12 Allowed 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -178.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -89.77 -45.16 9.48 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -176.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.506 ' HB2' ' O ' ' B' ' 372' ' ' ARG . 49.6 m -67.48 -20.78 65.51 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.753 -179.071 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.922 HD23 ' OE1' ' B' ' 373' ' ' GLN . 2.1 tp -110.82 -39.25 4.89 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 120.639 0.257 . . . . 0.0 110.836 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.615 HG22 ' H ' ' B' ' 379' ' ' GLY . 1.9 mm -126.91 -151.42 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.615 ' H ' HG22 ' B' ' 378' ' ' ILE . . . 40.81 64.85 1.14 Allowed Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.532 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.706 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 4.2 p90 -81.36 -61.74 1.86 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.558 0.179 . . . . 0.0 111.307 -179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.706 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 160.15 71.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 8.7 t 156.21 21.89 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.559 HD23 ' H ' ' B' ' 383' ' ' LEU . 0.8 OUTLIER -117.4 -26.39 6.7 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 122.063 -0.398 . . . . 0.0 110.949 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.497 ' HB3' ' O ' ' B' ' 383' ' ' LEU . 8.7 tpp180 79.59 48.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.552 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.74 HD23 ' N ' ' B' ' 386' ' ' HIS . 5.2 tt -84.25 132.57 34.63 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.74 ' N ' HD23 ' B' ' 385' ' ' LEU . 13.1 p-80 -164.94 147.8 8.36 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -179.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.463 ' CZ ' ' SG ' ' B' ' 404' ' ' CYS . 7.4 m-85 -103.26 144.92 30.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.133 178.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.611 HG23 ' HB2' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -123.97 125.17 70.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.167 0.508 . . . . 0.0 110.799 179.229 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.4 m -83.92 126.18 32.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.964 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.698 HG23 ' CG2' ' B' ' 401' ' ' ILE . 27.2 m -134.39 155.32 38.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.812 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.518 ' HB3' ' O ' ' B' ' 390' ' ' VAL . 11.6 tptp 86.82 57.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.599 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER -33.87 122.02 0.49 Allowed Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.515 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.438 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 17.1 Cg_exo -63.14 162.33 26.76 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.608 2.205 . . . . 0.0 112.701 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.9 p -134.49 170.14 16.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.888 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -93.47 16.93 12.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.833 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 29.5 m -135.9 11.8 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.441 178.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.433 ' O ' ' N ' ' B' ' 399' ' ' ASN . 1.1 m-20 163.78 64.84 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.218 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.477 ' O ' ' C ' ' B' ' 399' ' ' ASN . 4.7 Cg_exo -37.05 -28.88 0.08 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 123.557 2.838 . . . . 0.0 112.363 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.497 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 8.3 m120 -21.91 121.88 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.483 -0.781 . . . . 0.0 112.347 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 5.9 t -143.22 154.5 43.91 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.795 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.698 ' CG2' HG23 ' B' ' 390' ' ' VAL . 16.8 tt -120.26 159.08 21.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.343 0.592 . . . . 0.0 111.381 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.847 ' O ' HG22 ' B' ' 414' ' ' THR . 0.2 OUTLIER -121.08 152.61 24.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.276 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.611 ' HB2' HG23 ' B' ' 388' ' ' VAL . 32.3 mt-10 -122.12 125.31 45.9 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.981 0.42 . . . . 0.0 110.107 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.624 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 48.3 t -110.4 111.84 23.38 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.582 ' HB3' HG22 ' B' ' 411' ' ' VAL . 15.3 ptp180 -145.85 -175.86 4.91 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.232 0.539 . . . . 0.0 111.651 -179.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.618 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -146.68 144.96 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.134 -179.388 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' B' ' 408' ' ' ASP . . . 66.54 6.24 34.03 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.265 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . 0.498 ' HB3' ' O ' ' B' ' 407' ' ' GLY . 59.8 t0 74.85 39.66 0.4 Allowed 'General case' 0 C--O 1.23 0.078 0 CA-C-O 120.639 0.257 . . . . 0.0 111.536 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -167.12 -50.66 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.303 -0.951 . . . . 0.0 113.054 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.618 ' HB ' HG23 ' B' ' 406' ' ' VAL . 17.6 m -72.97 94.98 1.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.598 0.237 . . . . 0.0 111.2 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.582 HG22 ' HB3' ' B' ' 405' ' ' ARG . 95.4 t -82.82 111.46 19.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.786 0.327 . . . . 0.0 111.294 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.558 HD22 ' HA ' ' B' ' 405' ' ' ARG . 0.7 OUTLIER -65.44 -32.84 74.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.368 179.149 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.404 ' HA3' ' OD1' ' B' ' 430' ' ' ASN . . . 178.55 -158.25 22.63 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.608 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.847 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -156.19 167.67 29.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.791 0.329 . . . . 0.0 111.146 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.667 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -159.42 124.59 1.37 Allowed Glycine 0 C--O 1.225 -0.464 0 C-N-CA 120.531 -0.843 . . . . 0.0 112.572 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.438 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 10.1 p -124.33 151.88 29.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.778 0.323 . . . . 0.0 110.842 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.946 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -167.03 159.49 32.89 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.212 -0.994 . . . . 0.0 113.284 -179.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.4 OUTLIER -67.18 -45.68 76.21 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.402 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.822 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -98.68 30.17 3.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.215 0.531 . . . . 0.0 109.586 179.078 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.63 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 50.41 -44.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 115.227 1.566 . . . . 0.0 115.227 178.319 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.621 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -47.43 -48.93 26.24 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.595 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.946 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.06 -37.23 3.84 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.628 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.169 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -69.02 -46.51 67.77 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.698 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.97 -59.34 10.95 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.429 -0.891 . . . . 0.0 111.424 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.784 ' N ' HD13 ' B' ' 425' ' ' ILE . 1.2 mm -60.93 -40.15 84.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.804 0.335 . . . . 0.0 110.806 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.585 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 25.2 tpt180 -57.41 -42.09 81.6 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.376 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.643 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -62.12 -45.26 94.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.394 179.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.836 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -56.16 -59.47 4.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.37 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.49 ' O ' ' HB2' ' B' ' 433' ' ' ARG . 1.0 OUTLIER -50.73 -31.46 16.71 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.127 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.501 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -63.86 -39.74 94.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.646 179.532 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.624 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -65.0 -41.62 95.21 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 120.993 0.425 . . . . 0.0 110.324 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.673 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.3 OUTLIER -86.24 9.12 18.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.592 179.353 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 2.3 ttm-85 -93.99 11.4 29.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.767 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.553 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 2.3 m-20 -125.39 79.81 1.84 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.805 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.505 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 10.4 ptpt -46.27 -48.9 17.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.016 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.505 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 3.3 mtpp -57.62 -46.62 83.9 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.817 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.553 ' HB3' ' HB2' ' B' ' 434' ' ' ASP . 1.5 tmm? -64.27 -65.12 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.049 0.452 . . . . 0.0 109.895 179.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.673 HD11 ' HA ' ' B' ' 432' ' ' LEU . 44.6 mt -39.13 -67.59 0.21 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.05 179.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -47.8 -43.95 28.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.69 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.464 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -52.64 -32.57 42.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.969 179.868 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.447 ' HB2' ' O ' ' B' ' 438' ' ' LEU . 25.7 m-85 -75.57 -41.33 55.0 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.756 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.426 ' O ' ' HB2' ' B' ' 445' ' ' ARG . . . -49.25 -43.9 43.26 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . 0.403 ' HD3' ' N ' ' B' ' 444' ' ' GLN . 0.1 OUTLIER -62.85 -50.45 70.86 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.769 178.512 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.403 ' N ' ' HD3' ' B' ' 443' ' ' LYS . 0.0 OUTLIER -55.52 -36.57 66.87 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.775 179.064 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.617 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 5.0 mmm-85 . . . . . 0 CA--C 1.519 -0.214 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.489 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.694 ' HA ' HG23 ' B' ' 425' ' ' ILE . 0.4 OUTLIER . . . . . 0 C--O 1.237 0.447 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.482 ' CE ' ' ND2' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -32.91 -56.09 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.112 178.93 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . 0.482 ' ND2' ' CE ' ' B' ' 368' ' ' MET . 2.7 m-20 -52.31 -56.1 17.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.376 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.991 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -43.4 -75.99 0.03 OUTLIER 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.448 ' HD3' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -35.78 -38.07 0.11 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.22 0.533 . . . . 0.0 110.36 179.849 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.545 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.1 tmt_? -59.6 -55.86 29.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.324 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.695 ' HB3' HD22 ' B' ' 432' ' ' LEU . 0.2 OUTLIER -50.4 -32.23 17.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.736 179.614 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.759 HD11 ' OH ' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -71.34 -78.41 0.08 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.714 -178.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -79.44 12.76 2.28 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -178.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -128.09 -28.46 2.62 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.705 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.993 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.4 OUTLIER -110.03 -16.9 13.71 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.758 -179.646 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.993 HD13 ' O ' ' B' ' 377' ' ' LEU . 13.9 mm -132.35 -60.02 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 121.005 0.431 . . . . 0.0 110.041 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.618 ' HA2' HD12 ' B' ' 383' ' ' LEU . . . -53.04 143.56 25.31 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.146 179.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.641 ' CE1' ' CZ ' ' B' ' 445' ' ' ARG . 0.5 OUTLIER -143.95 -48.94 0.29 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.557 -0.322 . . . . 0.0 111.537 179.82 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.526 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 171.76 -26.06 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.46 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.565 ' HB2' ' CE2' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -111.22 -6.51 14.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.808 0.337 . . . . 0.0 110.913 179.817 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.827 HD13 ' HB2' ' B' ' 385' ' ' LEU . 0.1 OUTLIER -48.18 -51.58 24.5 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.923 -179.968 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.484 ' HG2' ' HA3' ' B' ' 407' ' ' GLY . 2.3 tpt180 77.56 6.4 2.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.607 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.827 ' HB2' HD13 ' B' ' 383' ' ' LEU . 3.7 tt -49.54 135.28 18.51 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.793 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.417 ' CD2' ' O ' ' B' ' 386' ' ' HIS . 8.7 p-80 -153.35 134.46 14.06 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.365 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.759 ' OH ' HD11 ' B' ' 374' ' ' LEU . 6.9 m-85 -92.41 140.97 29.04 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.8 179.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -125.62 124.61 67.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.977 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 6.9 m -82.19 130.79 35.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.322 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 1.007 HG23 HG23 ' B' ' 401' ' ' ILE . 21.6 m -135.25 160.07 40.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.279 0.562 . . . . 0.0 110.983 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.653 ' CB ' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 73.85 53.7 0.11 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.533 -179.623 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.476 ' C ' ' O ' ' B' ' 391' ' ' LYS . 3.7 mmtp -25.52 136.29 0.08 OUTLIER Pre-proline 0 N--CA 1.464 0.269 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.425 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -68.55 160.73 48.09 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.26 1.973 . . . . 0.0 112.59 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 1.5 p -127.59 158.79 36.55 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.835 -179.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -87.05 14.71 7.0 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.266 178.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 31.2 m -141.51 14.51 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.315 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 168.87 61.13 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 114.697 -1.138 . . . . 0.0 109.284 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.495 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 78.3 Cg_exo -41.8 -31.18 1.29 Allowed 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.329 2.686 . . . . 0.0 113.274 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.554 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.6 p-10 -28.39 119.32 0.12 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.803 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.51 150.41 52.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.578 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 1.007 HG23 HG23 ' B' ' 390' ' ' VAL . 0.2 OUTLIER -107.22 150.38 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.303 -179.897 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.721 ' CG2' ' HB1' ' B' ' 423' ' ' ALA . 0.1 OUTLIER -121.75 153.28 25.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.341 -179.818 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.446 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 7.3 mt-10 -123.69 132.77 53.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.856 0.36 . . . . 0.0 110.174 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.579 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -115.84 115.2 25.84 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.44 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.601 ' HB3' HG22 ' B' ' 411' ' ' VAL . 2.1 ptm180 -143.73 -164.19 1.82 Allowed 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.173 0.511 . . . . 0.0 111.486 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.667 HG12 ' CA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -145.44 144.31 21.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.288 -179.401 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . 0.484 ' HA3' ' HG2' ' B' ' 384' ' ' ARG . . . -36.21 -29.96 0.02 OUTLIER Glycine 0 C--N 1.331 0.298 0 CA-C-N 115.744 -0.662 . . . . 0.0 113.309 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' B' ' 406' ' ' VAL . 2.8 t70 -66.08 -8.23 22.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.77 0.319 . . . . 0.0 110.899 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 86.68 39.88 7.45 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.462 -179.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.514 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 53.1 m -129.05 116.44 19.3 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.601 HG22 ' HB3' ' B' ' 405' ' ' ARG . 48.1 t -86.19 110.95 20.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.887 178.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.993 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -64.49 -34.75 78.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.356 . . . . 0.0 110.304 179.742 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.449 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . -176.4 -154.9 12.24 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.677 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.467 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 12.9 t -173.78 168.99 4.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.693 0.283 . . . . 0.0 110.743 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.476 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -167.35 167.46 39.91 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.399 -0.905 . . . . 0.0 113.033 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.18 150.82 18.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 122.276 0.23 . . . . 0.0 110.388 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.855 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -160.26 143.5 9.1 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.927 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.495 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 15.1 ptt180 -56.16 -47.04 79.01 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.839 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.5 OUTLIER -99.75 34.38 2.28 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 178.884 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.723 ' C ' HD12 ' B' ' 420' ' ' ILE . 0.5 OUTLIER 46.35 -46.23 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 N-CA-C 115.506 1.669 . . . . 0.0 115.506 178.609 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.686 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -46.01 -48.17 16.7 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 -179.129 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.855 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -48.52 -40.12 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.719 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.109 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.721 ' HB1' ' CG2' ' B' ' 402' ' ' VAL . . . -63.51 -44.28 94.77 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.363 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.07 -65.22 3.23 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.484 -0.865 . . . . 0.0 111.456 178.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.694 HG23 ' HA ' ' B' ' 367' ' ' ASP . 4.4 mm -52.94 -35.85 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.059 0.456 . . . . 0.0 110.382 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.581 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 3.6 tpt180 -63.45 -49.12 74.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.531 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.525 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -51.71 -41.73 61.7 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.287 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.991 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -58.76 -62.22 2.03 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.31 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.524 ' HA ' HD11 ' B' ' 432' ' ' LEU . 0.3 OUTLIER -53.78 -20.44 5.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.244 179.295 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.469 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 1.9 m-80 -76.1 -40.05 53.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.812 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.423 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -64.62 -39.08 93.07 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.253 0.549 . . . . 0.0 109.579 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.916 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.2 OUTLIER -85.19 8.09 19.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.538 179.008 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.408 ' HB2' ' HA ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -87.85 -1.6 58.08 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.276 -179.759 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.552 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 6.3 m-20 -111.44 83.56 1.79 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.918 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.479 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 1.6 ptmm? -50.75 -49.4 58.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.006 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.479 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 4.2 mmtp -61.36 -45.1 95.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.166 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.993 ' SD ' HD12 ' B' ' 412' ' ' LEU . 2.0 ttp -67.63 -51.45 49.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.939 0.4 . . . . 0.0 110.488 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.916 HD11 ' HA ' ' B' ' 432' ' ' LEU . 80.6 mt -51.13 -62.62 1.5 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.213 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -50.99 -38.72 52.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.317 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.58 ' CZ ' ' OE1' ' B' ' 444' ' ' GLN . 0.9 OUTLIER -55.23 -36.8 66.39 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.7 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.665 ' CB ' HG23 ' B' ' 378' ' ' ILE . 32.1 m-85 -73.36 -46.04 51.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.163 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.416 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -41.88 -51.03 4.42 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -64.09 -42.18 97.03 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.58 ' OE1' ' CZ ' ' B' ' 440' ' ' PHE . 0.0 OUTLIER -53.59 -42.51 67.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.168 179.018 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.641 ' CZ ' ' CE1' ' B' ' 380' ' ' TYR . 40.2 mmt-85 . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.624 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.434 ' O ' ' HG2' ' B' ' 371' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.232 0 CA-C-O 120.964 0.412 . . . . 0.0 109.978 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.515 ' N ' ' HE3' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -36.09 -66.7 0.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.617 179.6 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -38.23 -48.87 1.33 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.5 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 1.118 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -60.38 -80.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.245 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.515 ' HE3' ' N ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -33.61 -40.44 0.07 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.99 0.424 . . . . 0.0 110.725 179.761 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.543 ' CZ ' ' HB3' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -57.13 -59.61 4.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.102 179.191 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.521 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -47.62 -49.46 27.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.171 0.51 . . . . 0.0 111.215 179.615 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.537 HD13 ' OH ' ' B' ' 387' ' ' TYR . 0.9 OUTLIER -52.28 -70.51 0.09 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.263 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . 0.557 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.5 m-85 -80.72 -48.33 12.7 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -177.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.526 ' CB ' ' HD2' ' B' ' 372' ' ' ARG . 8.2 t -59.88 -26.45 65.88 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 -178.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.802 ' O ' HD13 ' B' ' 378' ' ' ILE . 4.4 mm? -120.63 -25.24 5.56 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -178.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.802 HD13 ' O ' ' B' ' 377' ' ' LEU . 3.1 mm -133.23 35.91 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.557 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -140.97 82.73 0.23 Allowed Glycine 0 C--N 1.33 0.215 0 C-N-CA 120.084 -1.055 . . . . 0.0 113.344 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.561 ' CD2' ' HD3' ' B' ' 445' ' ' ARG . 15.7 p90 -99.39 24.34 8.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.103 0.477 . . . . 0.0 109.872 178.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.532 ' HB3' ' O ' ' B' ' 380' ' ' TYR . . . 80.04 -89.46 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.497 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.442 ' C ' ' O ' ' B' ' 381' ' ' ALA . 55.6 m -33.2 -38.53 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.3 -179.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.574 HD22 HG11 ' B' ' 406' ' ' VAL . 0.7 OUTLIER -41.49 -39.7 1.6 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.9 0.381 . . . . 0.0 110.968 -179.612 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.06 35.87 2.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.42 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.771 ' HA ' HG12 ' B' ' 406' ' ' VAL . 8.9 tt -75.03 123.86 25.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.547 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -147.9 147.35 29.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.539 0.685 . . . . 0.0 112.194 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.579 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 4.4 m-85 -92.47 155.43 17.85 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.935 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.36 125.19 53.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 4.3 m -88.72 131.53 34.99 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.597 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 1.061 HG23 HG23 ' B' ' 401' ' ' ILE . 16.3 m -137.16 158.27 35.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.324 0.583 . . . . 0.0 111.454 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.791 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.1 OUTLIER 79.54 64.38 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.361 179.626 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.421 ' HA ' ' HD2' ' B' ' 393' ' ' PRO . 0.4 OUTLIER -39.46 103.79 0.3 Allowed Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.642 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.477 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 1.8 Cg_endo -45.99 165.52 0.07 OUTLIER 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.81 2.34 . . . . 0.0 112.961 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 3.1 p -124.38 162.27 24.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.671 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -85.4 12.44 8.32 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.509 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 20.3 m -141.5 10.0 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.249 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.533 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 0.2 OUTLIER -174.32 51.04 0.1 OUTLIER Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.465 -179.796 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.533 ' CD ' ' N ' ' B' ' 397' ' ' ASP . 95.4 Cg_exo -31.21 -29.52 0.02 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 124.164 3.242 . . . . 0.0 114.105 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.532 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.5 p-10 -37.06 129.38 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.822 0.344 . . . . 0.0 111.0 -179.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 28.4 t -143.94 158.56 43.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.237 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 1.061 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -116.25 144.55 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-O 121.182 0.515 . . . . 0.0 111.771 -179.438 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.813 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.0 OUTLIER -127.11 128.67 70.71 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.603 179.951 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.503 ' CG ' ' OG1' ' B' ' 414' ' ' THR . 2.9 mt-10 -110.64 131.49 55.01 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.609 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.579 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 1.4 p -93.63 141.17 28.79 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.78 ' HA ' HD22 ' B' ' 412' ' ' LEU . 0.9 OUTLIER -162.16 -175.28 4.5 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.275 0.56 . . . . 0.0 112.345 -179.552 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.771 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -136.69 145.75 29.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.954 -179.622 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -34.89 -34.44 0.05 OUTLIER Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.654 -0.703 . . . . 0.0 113.742 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -60.82 -12.97 12.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.974 0.416 . . . . 0.0 110.726 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 91.03 36.3 6.75 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.722 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.554 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 18.5 m -118.65 116.46 26.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.538 0.209 . . . . 0.0 111.312 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.502 ' HA ' ' CB ' ' B' ' 405' ' ' ARG . 33.7 t -82.88 96.64 3.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.176 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.78 HD22 ' HA ' ' B' ' 405' ' ' ARG . 0.2 OUTLIER -50.89 -26.16 5.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.963 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.51 ' N ' ' SG ' ' B' ' 404' ' ' CYS . . . -177.44 -177.26 46.17 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 119.462 -1.351 . . . . 0.0 113.954 -179.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.791 ' CG2' HD11 ' B' ' 401' ' ' ILE . 6.3 m -148.56 120.08 7.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.28 -0.46 . . . . 0.0 110.469 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.585 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -130.48 163.77 23.11 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.419 -0.895 . . . . 0.0 113.152 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.467 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 3.2 p -135.33 161.06 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.763 -0.218 . . . . 0.0 110.416 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.819 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -155.87 115.61 0.67 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.043 -1.075 . . . . 0.0 113.424 -179.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.472 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -44.55 -54.82 5.67 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 122.189 0.196 . . . . 0.0 111.337 179.6 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.85 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.7 OUTLIER -86.98 -5.92 58.93 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.111 178.865 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.85 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.6 OUTLIER 94.46 -45.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 C-N-CA 123.65 0.78 . . . . 0.0 112.262 179.5 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -47.03 -60.56 2.37 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.616 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.819 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -42.26 -32.69 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.509 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.779 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -68.09 -45.95 72.34 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.146 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.509 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.54 -58.19 12.16 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 119.81 -1.186 . . . . 0.0 111.519 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.691 ' N ' HD13 ' B' ' 425' ' ' ILE . 1.9 mm -59.57 -36.28 64.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.768 0.318 . . . . 0.0 110.744 179.415 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.4 OUTLIER -62.15 -56.03 22.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.063 179.489 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.813 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -45.02 -42.3 8.24 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.017 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 1.118 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -53.62 -66.17 0.44 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.004 178.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.513 ' O ' ' N ' ' B' ' 433' ' ' ARG . 1.1 mt-10 -47.27 -44.37 22.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.687 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.441 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 0.7 OUTLIER -55.87 -29.49 60.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.909 179.685 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.452 ' HB3' HD22 ' B' ' 374' ' ' LEU . . . -72.3 -48.45 42.12 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 120.826 0.346 . . . . 0.0 110.421 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.847 HD13 ' H ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -97.05 13.36 29.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.818 179.437 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -87.07 7.24 28.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.982 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.571 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 2.0 m-20 -117.65 74.65 0.94 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.918 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.435 ' C ' ' O ' ' B' ' 434' ' ' ASP . 14.3 ptmt -36.84 -43.85 0.46 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.499 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.432 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.1 OUTLIER -64.36 -47.92 77.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.397 179.768 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.629 ' SD ' HD12 ' B' ' 412' ' ' LEU . 2.0 ttp -60.79 -51.46 69.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.416 179.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.681 HD11 ' HB2' ' B' ' 432' ' ' LEU . 60.0 mt -58.0 -57.78 11.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.592 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -53.02 -30.42 35.28 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.914 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.466 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.6 OUTLIER -66.38 -40.85 89.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.501 179.191 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.572 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 42.9 m-85 -75.12 -49.49 19.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.812 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -41.48 -46.32 3.44 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -38.88 81.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.355 178.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.572 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -60.08 -26.78 66.44 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.119 179.122 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.561 ' HD3' ' CD2' ' B' ' 380' ' ' TYR . 1.4 mmm180 . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.563 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.478 ' HB2' ' NZ ' ' B' ' 371' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.929 0.395 . . . . 0.0 110.667 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.503 ' HA ' ' CD ' ' B' ' 371' ' ' LYS . 4.2 tmm? -39.58 -46.36 1.76 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.666 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -56.45 -52.75 63.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.411 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.895 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -50.9 -69.78 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.022 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.503 ' CD ' ' HA ' ' B' ' 368' ' ' MET . 5.1 mttp -31.36 -53.71 0.23 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.124 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.535 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.7 ttt-85 -51.59 -45.92 63.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.553 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -57.14 -47.02 82.18 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.173 0.511 . . . . 0.0 110.737 179.491 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.608 HD23 ' N ' ' B' ' 374' ' ' LEU . 3.6 mt -53.91 -68.57 0.17 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -179.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -85.73 -42.21 14.44 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -177.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.7 OUTLIER -67.84 -27.94 67.13 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.218 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.684 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.3 OUTLIER -106.32 -31.34 8.66 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.773 0.32 . . . . 0.0 110.765 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.748 HG22 HD22 ' B' ' 383' ' ' LEU . 1.3 mm -137.24 -148.08 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.529 ' H ' HG22 ' B' ' 378' ' ' ILE . . . 28.73 72.83 0.04 OUTLIER Glycine 0 C--N 1.332 0.359 0 C-N-CA 121.23 -0.509 . . . . 0.0 113.45 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.637 ' CE1' HD13 ' B' ' 383' ' ' LEU . 10.4 p90 -89.93 -55.41 3.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.662 0.268 . . . . 0.0 111.116 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -176.69 -48.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.817 0.342 . . . . 0.0 111.366 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.48 16.65 4.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.124 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.748 HD22 HG22 ' B' ' 378' ' ' ILE . 2.9 tp -103.21 -27.77 12.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.028 0.442 . . . . 0.0 110.807 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 8.0 tpp85 62.32 15.71 7.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.971 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.681 ' HA ' HG12 ' B' ' 406' ' ' VAL . 6.5 tt -48.02 128.74 14.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.702 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.552 ' CD2' ' O ' ' B' ' 386' ' ' HIS . 0.6 OUTLIER -158.59 136.95 10.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.304 0.573 . . . . 0.0 112.25 -179.639 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.582 ' CZ ' ' HB3' ' B' ' 404' ' ' CYS . 6.9 m-85 -87.86 162.93 16.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.578 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.591 HG23 ' O ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -138.35 147.58 25.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.97 178.498 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . 0.446 HG22 ' O ' ' B' ' 389' ' ' THR . 1.0 OUTLIER -112.12 109.94 19.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 0.0 110.668 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.956 HG23 HG23 ' B' ' 401' ' ' ILE . 29.7 m -112.51 155.13 13.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.559 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.634 ' HB3' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 67.68 69.38 0.35 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.413 -179.665 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.424 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 17.0 mmtt -54.56 149.27 21.88 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.097 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.511 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 11.2 Cg_exo -72.55 165.06 33.8 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 123.081 2.521 . . . . 0.0 112.526 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.471 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 1.2 p -156.47 165.84 35.14 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.498 179.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -79.37 4.78 14.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.846 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . 0.582 HG23 ' OD2' ' B' ' 397' ' ' ASP . 6.1 m -130.99 17.06 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.292 0.568 . . . . 0.0 109.558 178.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.582 ' OD2' HG23 ' B' ' 396' ' ' VAL . 2.8 p30 166.02 60.42 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.967 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.511 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 96.3 Cg_exo -39.4 -54.72 1.76 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.045 2.497 . . . . 0.0 112.934 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.494 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.8 OUTLIER -21.65 137.01 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.402 -178.558 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -143.69 141.53 30.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.973 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.956 HG23 HG23 ' B' ' 390' ' ' VAL . 0.1 OUTLIER -111.16 139.0 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 CA-C-O 121.465 0.65 . . . . 0.0 111.776 -179.055 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.781 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -102.27 176.65 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.055 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.591 ' O ' HG23 ' B' ' 388' ' ' VAL . 4.9 mt-10 -156.2 106.98 2.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.984 0.421 . . . . 0.0 110.833 179.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.582 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -88.64 128.45 35.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.482 ' HA ' ' O ' ' B' ' 410' ' ' THR . 12.5 ptt180 -155.19 173.09 17.11 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.642 -179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.681 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -132.81 132.59 59.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.87 -179.249 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' B' ' 406' ' ' VAL . . . -30.95 -32.14 0.01 OUTLIER Glycine 0 C--N 1.333 0.407 0 O-C-N 123.436 0.46 . . . . 0.0 113.555 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . 0.545 ' N ' ' O ' ' B' ' 406' ' ' VAL . 21.4 t0 -57.17 -16.42 7.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.014 0.435 . . . . 0.0 110.387 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 95.72 35.86 5.49 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.785 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.482 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 16.9 m -128.28 124.79 37.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.082 0.468 . . . . 0.0 111.737 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.489 HG13 ' O ' ' B' ' 404' ' ' CYS . 47.9 t -89.2 89.43 3.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.525 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.643 HD12 ' CE ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -46.01 -26.44 0.73 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.897 0.38 . . . . 0.0 110.23 -179.928 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.46 ' O ' HG12 ' B' ' 411' ' ' VAL . . . 177.61 -173.77 46.37 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.858 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.467 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 3.4 t -160.64 171.37 19.03 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.667 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -173.01 170.41 43.56 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 118.525 -1.798 . . . . 0.0 114.836 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.526 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 5.2 p -136.76 152.05 28.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.321 -0.439 . . . . 0.0 110.209 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.809 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -153.66 111.54 0.49 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.904 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -42.05 -56.77 2.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.739 0.304 . . . . 0.0 110.923 179.706 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.893 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.1 OUTLIER -82.7 -11.27 58.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.248 179.151 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.893 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 97.12 -44.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.249 0 C-N-CA 123.873 0.869 . . . . 0.0 111.903 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.506 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.5 OUTLIER -48.08 -59.31 3.48 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.534 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.809 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -41.86 -31.42 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 177.845 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.793 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -71.65 -45.33 62.34 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.687 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.11 -59.9 9.27 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 119.906 -1.14 . . . . 0.0 111.702 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.736 ' N ' HD13 ' B' ' 425' ' ' ILE . 1.2 mm -57.84 -51.23 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.89 0.376 . . . . 0.0 110.797 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.567 ' HG2' ' HA3' ' B' ' 415' ' ' GLY . 0.0 OUTLIER -46.37 -51.17 15.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.237 179.687 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.588 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -51.1 -54.15 27.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.807 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.895 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -51.94 -65.5 0.55 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.253 0.549 . . . . 0.0 110.639 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.664 ' HA ' HD21 ' B' ' 432' ' ' LEU . 55.9 mt-10 -52.87 -19.52 2.61 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.443 179.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.485 ' ND2' ' HG3' ' B' ' 426' ' ' ARG . 0.8 OUTLIER -77.97 -32.47 51.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.34 -179.795 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.3 -42.53 44.96 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.345 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.964 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -87.33 14.48 7.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.759 179.807 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.495 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 8.2 ttt85 -88.01 4.65 44.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.67 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.564 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 12.7 m-20 -116.07 72.37 0.81 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.074 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' B' ' 436' ' ' LYS . 15.2 ptpt -41.69 -47.33 3.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.686 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.518 ' N ' ' HG3' ' B' ' 435' ' ' LYS . 1.7 mmmm -58.4 -47.63 83.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.146 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.643 ' CE ' HD12 ' B' ' 412' ' ' LEU . 13.2 tmm? -65.79 -54.7 23.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.012 0.434 . . . . 0.0 109.864 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.964 HD11 ' HA ' ' B' ' 432' ' ' LEU . 99.2 mt -51.61 -68.07 0.2 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.221 179.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -44.41 -36.2 2.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.859 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.633 ' CE2' ' CE1' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -60.98 -41.91 97.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.26 0.552 . . . . 0.0 109.639 179.692 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.633 ' CE1' ' CE2' ' B' ' 440' ' ' PHE . 40.9 m-85 -75.54 -33.7 60.7 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.545 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.81 -46.1 64.14 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.93 -45.62 77.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.479 178.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.583 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -57.99 -25.92 61.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.306 179.376 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.577 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.434 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.472 ' N ' ' OD1' ' B' ' 367' ' ' ASP . 0.5 OUTLIER . . . . . 0 C--O 1.233 0.226 0 CA-C-O 120.774 0.321 . . . . 0.0 110.4 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.603 ' CE ' ' ND2' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -37.49 -44.75 0.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.54 -179.846 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . 0.603 ' ND2' ' CE ' ' B' ' 368' ' ' MET . 5.2 m-20 -52.1 -57.97 7.96 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.057 0.456 . . . . 0.0 110.337 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.941 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -57.66 -72.51 0.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.622 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.545 ' CG ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -36.04 -31.92 0.03 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.977 0.418 . . . . 0.0 110.21 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.581 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.1 OUTLIER -65.42 -54.02 34.7 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.56 178.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.709 ' HG2' HD22 ' B' ' 377' ' ' LEU . 0.0 OUTLIER -53.73 -37.89 63.8 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.367 0.603 . . . . 0.0 110.328 179.017 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.543 HD23 ' N ' ' B' ' 374' ' ' LEU . 2.9 mt -64.56 -79.37 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -178.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -85.47 12.42 8.49 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.581 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -127.2 -15.38 5.24 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.686 -0.406 . . . . 0.0 111.741 179.805 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 1.053 ' O ' HD13 ' B' ' 378' ' ' ILE . 9.0 mp -124.98 -21.77 4.62 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.808 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 1.053 HD13 ' O ' ' B' ' 377' ' ' LEU . 12.1 mm -137.41 -72.39 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.619 ' HA2' HD13 ' B' ' 383' ' ' LEU . . . -47.14 79.45 0.0 OUTLIER Glycine 0 CA--C 1.52 0.37 0 CA-C-N 116.201 -0.454 . . . . 0.0 113.807 -179.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.591 ' CD2' HD12 ' B' ' 383' ' ' LEU . 45.3 p90 -76.9 -161.07 0.18 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.649 0.261 . . . . 0.0 111.058 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.553 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -84.7 105.73 15.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.693 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.553 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.1 t 91.22 47.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.719 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.78 HD23 ' O ' ' B' ' 383' ' ' LEU . 4.5 tt -101.93 -23.21 14.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.889 0.376 . . . . 0.0 110.276 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.493 ' O ' ' ND1' ' B' ' 386' ' ' HIS . 13.7 tpt180 81.28 5.0 1.4 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.354 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.603 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 6.1 tt -57.13 135.23 56.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.945 0.403 . . . . 0.0 110.376 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.529 ' N ' HD23 ' B' ' 385' ' ' LEU . 18.3 p-80 -167.05 147.41 5.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.405 0.621 . . . . 0.0 112.375 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.531 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 4.1 m-85 -98.85 138.66 35.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.385 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.515 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -118.01 118.77 59.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.298 0.57 . . . . 0.0 110.629 179.272 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 53.9 m -78.64 129.19 34.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.982 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 1.003 HG23 HG23 ' B' ' 401' ' ' ILE . 27.3 m -136.71 154.29 31.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.666 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.707 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 84.88 49.27 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.354 -179.539 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.444 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER -29.76 109.44 0.25 Allowed Pre-proline 0 N--CA 1.462 0.144 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.33 -179.433 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.459 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 1.9 Cg_endo -48.01 158.54 0.84 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 122.816 2.344 . . . . 0.0 113.422 -179.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.509 ' HG1' ' CG ' ' B' ' 397' ' ' ASP . 40.2 p -124.69 165.01 18.69 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.729 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -88.63 15.8 7.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.802 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . 0.574 ' O ' ' CG2' ' B' ' 396' ' ' VAL . 0.2 OUTLIER -141.6 9.56 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.937 0.875 . . . . 0.0 109.909 179.51 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.509 ' CG ' ' HG1' ' B' ' 394' ' ' THR . 3.5 p-10 171.22 59.12 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.543 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.481 ' O ' ' C ' ' B' ' 399' ' ' ASN . 5.2 Cg_exo -39.34 -31.55 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 123.611 2.874 . . . . 0.0 112.412 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.511 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 13.9 m120 -25.38 109.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.568 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . 0.409 ' O ' HG23 ' B' ' 416' ' ' VAL . 12.9 m -127.92 162.53 26.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.605 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 1.003 HG23 HG23 ' B' ' 390' ' ' VAL . 0.6 OUTLIER -119.78 151.01 22.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.517 -179.882 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.726 ' CG2' ' HB1' ' B' ' 423' ' ' ALA . 0.1 OUTLIER -120.27 154.3 23.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.515 ' CB ' HG23 ' B' ' 388' ' ' VAL . 13.6 mm-40 -122.81 130.15 52.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.809 0.338 . . . . 0.0 110.685 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.532 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.5 OUTLIER -112.43 112.67 24.39 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.842 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.52 ' CG ' ' N ' ' B' ' 406' ' ' VAL . 0.1 OUTLIER -138.64 -166.33 1.99 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 121.349 0.595 . . . . 0.0 111.888 -178.823 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.753 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -157.79 140.4 6.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.328 -179.354 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . 0.46 ' HA2' ' HG2' ' B' ' 384' ' ' ARG . . . 64.78 6.73 25.24 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.551 -0.833 . . . . 0.0 111.322 -178.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 20.6 t70 72.41 35.45 1.17 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.685 0.279 . . . . 0.0 111.11 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -155.73 -49.46 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.497 -0.858 . . . . 0.0 113.22 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.753 ' HB ' HG23 ' B' ' 406' ' ' VAL . 53.4 m -82.12 105.65 13.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.681 0.277 . . . . 0.0 111.68 -179.4 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.408 ' CG1' ' OE1' ' B' ' 403' ' ' GLU . 79.1 t -90.06 111.07 22.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.651 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.889 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -64.65 -35.23 80.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.313 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.462 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 175.76 -148.68 9.5 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.561 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.501 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 8.7 t -168.53 166.84 11.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.776 0.322 . . . . 0.0 111.301 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.576 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -154.8 136.87 5.38 Favored Glycine 0 C--O 1.228 -0.259 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.679 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.535 ' HB ' HD12 ' B' ' 401' ' ' ILE . 8.4 p -122.69 149.19 26.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.893 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -163.63 151.88 21.57 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.135 -1.031 . . . . 0.0 113.24 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.481 ' HG3' ' OD1' ' B' ' 419' ' ' ASN . 0.6 OUTLIER -62.83 -45.45 92.56 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.359 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.842 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.5 OUTLIER -100.02 32.19 3.03 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.892 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.668 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 47.42 -44.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 178.499 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.623 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -47.88 -45.46 30.45 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 119.12 0.873 . . . . 0.0 108.93 -179.219 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.893 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -49.95 -40.55 16.68 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.785 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 177.873 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.726 ' HB1' ' CG2' ' B' ' 402' ' ' VAL . . . -62.2 -46.04 90.66 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.492 178.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.49 -70.03 1.13 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.404 -0.903 . . . . 0.0 111.604 178.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.471 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 0.5 OUTLIER -50.92 -33.47 12.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.315 179.284 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.586 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 1.5 tpt180 -63.76 -57.89 8.56 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.513 179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.616 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -42.97 -39.59 2.66 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.941 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -60.29 -60.46 3.78 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.542 ' O ' HD22 ' B' ' 432' ' ' LEU . 32.2 mt-10 -47.66 -21.28 0.35 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.281 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.501 ' ND2' ' O ' ' B' ' 414' ' ' THR . 1.7 m-80 -81.57 -36.48 29.01 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.741 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.455 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -63.62 -38.38 90.91 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.161 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.685 HD13 ' O ' ' B' ' 428' ' ' ALA . 0.0 OUTLIER -94.08 11.68 29.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.991 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 0.9 OUTLIER -92.8 4.62 53.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.142 -179.79 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.544 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 15.6 m-20 -119.31 92.14 3.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 0.0 110.85 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.438 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -56.38 -46.43 80.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.476 -179.635 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.438 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -60.61 -42.14 96.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.943 0.401 . . . . 0.0 110.548 -179.8 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.889 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -71.37 -46.49 60.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.164 179.442 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.55 HD11 ' HA ' ' B' ' 432' ' ' LEU . 54.5 mt -56.12 -65.41 0.61 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.115 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -51.16 -36.48 41.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.97 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.466 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.9 OUTLIER -53.55 -44.42 69.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.67 179.642 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.788 ' CB ' HG23 ' B' ' 378' ' ' ILE . 43.0 m-85 -65.16 -49.47 69.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.539 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.412 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -39.24 -51.19 1.99 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -38.81 92.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.979 178.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.517 ' N ' ' O ' ' B' ' 441' ' ' TYR . 3.5 mt-30 -64.6 -36.76 85.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.044 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.501 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.159 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.57 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.519 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.482 ' O ' ' HB2' ' B' ' 372' ' ' ARG . 1.7 ttp -36.17 -43.0 0.33 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.509 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -64.27 -43.27 95.34 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.85 0.357 . . . . 0.0 110.681 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.979 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -65.75 -74.87 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.438 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.482 ' HD2' ' HB2' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -33.92 -46.18 0.22 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.104 0.478 . . . . 0.0 110.571 179.826 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.492 ' O ' ' HB3' ' B' ' 376' ' ' SER . 9.5 ttp85 -60.44 -45.85 92.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.004 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.2 OUTLIER -60.17 -53.15 61.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.0 -179.244 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.714 HD23 ' N ' ' B' ' 374' ' ' LEU . 0.3 OUTLIER -56.74 -64.13 0.97 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -178.448 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . 0.538 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.3 m-85 -78.26 -52.09 9.17 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -177.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.492 ' HB3' ' O ' ' B' ' 372' ' ' ARG . 1.3 t -69.05 -29.15 67.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.877 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.9 OUTLIER -102.89 -35.53 8.56 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.665 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.877 HD13 ' O ' ' B' ' 377' ' ' LEU . 8.1 mm -136.01 37.44 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.538 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -121.61 81.13 0.34 Allowed Glycine 0 CA--C 1.517 0.207 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.8 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 1.1 ' CE2' HD12 ' B' ' 383' ' ' LEU . 36.1 p90 -105.11 174.37 5.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.887 0.375 . . . . 0.0 110.812 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -80.07 82.17 6.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.15 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.508 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 0.6 OUTLIER 160.71 -31.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.162 179.792 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 1.1 HD12 ' CE2' ' B' ' 380' ' ' TYR . 0.2 OUTLIER -54.21 -54.97 32.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.925 0.393 . . . . 0.0 110.468 179.784 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' B' ' 385' ' ' LEU . 5.4 tpt180 76.28 46.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.414 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.845 ' HA ' HG12 ' B' ' 406' ' ' VAL . 3.0 mt -38.82 140.22 0.38 Allowed 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -140.8 89.27 2.25 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -177.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.683 ' HE1' HD22 ' B' ' 385' ' ' LEU . 39.7 m-85 -91.87 122.76 34.7 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 177.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -114.83 118.16 57.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.396 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 8.4 m -83.81 110.16 18.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.657 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.811 HG23 HG23 ' B' ' 401' ' ' ILE . 35.9 m -115.92 149.93 18.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.16 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.657 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 88.68 58.54 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.077 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.448 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 0.0 OUTLIER -38.13 142.89 0.44 Allowed Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.507 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' B' ' 392' ' ' LYS . 7.0 Cg_exo -71.37 158.76 53.5 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.181 1.921 . . . . 0.0 113.019 -178.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.455 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 34.8 p -129.62 161.02 31.51 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.355 -179.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -85.32 14.26 5.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.563 179.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 4.7 m -136.89 9.26 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.886 178.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.402 ' CG ' ' OD1' ' B' ' 399' ' ' ASN . 0.2 OUTLIER 168.7 62.94 0.01 OUTLIER Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.785 -179.483 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.455 ' HA ' ' H ' ' B' ' 394' ' ' THR . 1.6 Cg_endo -42.08 -35.71 3.44 Favored 'Trans proline' 0 N--CA 1.464 -0.225 0 C-N-CA 123.687 2.925 . . . . 0.0 112.572 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.539 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.2 p-10 -29.01 121.12 0.13 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.041 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 1.3 t -131.42 162.5 30.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.053 179.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.811 HG23 HG23 ' B' ' 390' ' ' VAL . 0.0 OUTLIER -120.42 155.87 23.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.963 0.411 . . . . 0.0 111.501 -179.423 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.757 ' N ' HD13 ' B' ' 401' ' ' ILE . 0.1 OUTLIER -126.45 139.73 50.84 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.831 -179.591 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -102.26 119.86 39.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.939 0.399 . . . . 0.0 110.476 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.658 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 5.6 t -92.22 95.35 9.67 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.513 ' HA ' ' O ' ' B' ' 410' ' ' THR . 35.3 ttp180 -129.16 162.27 28.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.461 -178.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.845 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -139.64 144.56 28.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.074 -179.657 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 55.97 14.0 7.36 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.298 -0.953 . . . . 0.0 111.296 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 13.1 t70 57.51 23.01 8.67 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 120.801 0.334 . . . . 0.0 110.288 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -139.96 -0.71 1.92 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.238 -0.982 . . . . 0.0 113.703 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.675 ' HB ' HG23 ' B' ' 406' ' ' VAL . 23.3 m -142.83 117.59 9.87 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 117.237 0.518 . . . . 0.0 111.759 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.484 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 73.4 t -95.55 108.51 21.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.589 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.794 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -63.06 -37.2 86.24 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.85 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 175.21 -139.93 5.01 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.213 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.684 ' OG1' HD11 ' B' ' 401' ' ' ILE . 3.0 t -170.12 168.48 8.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.684 0.278 . . . . 0.0 110.854 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.648 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -159.99 131.84 2.8 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.497 -0.858 . . . . 0.0 112.424 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.463 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 7.7 p -119.15 146.05 24.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.873 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -154.53 144.37 11.08 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.057 -1.068 . . . . 0.0 112.992 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.452 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 5.5 ptm180 -57.01 -45.87 82.73 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.846 0.355 . . . . 0.0 111.69 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.808 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -99.34 29.41 3.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.274 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.767 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.5 OUTLIER 50.74 -45.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 179.133 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.629 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -45.24 -56.73 4.55 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 118.884 0.765 . . . . 0.0 109.247 179.884 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.873 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -42.01 -33.77 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 177.882 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.767 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -67.82 -48.62 65.72 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.047 -0.979 . . . . 0.0 109.781 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -60.9 -58.8 11.9 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 119.866 -1.159 . . . . 0.0 111.345 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.602 ' H ' HD12 ' B' ' 425' ' ' ILE . 3.4 mp -56.27 -39.55 60.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.503 179.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.576 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.8 tpt180 -61.84 -52.31 64.69 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.342 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.644 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -45.6 -42.01 10.7 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.979 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -60.28 -58.18 9.62 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.521 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.581 ' O ' ' CD2' ' B' ' 432' ' ' LEU . 2.9 tm-20 -52.92 -17.18 1.28 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.552 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.504 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 1.4 m-80 -81.02 -38.92 26.66 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.096 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.658 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -62.61 -45.26 93.68 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.916 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.816 ' C ' HD23 ' B' ' 432' ' ' LEU . 0.1 OUTLIER -83.29 1.86 38.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.756 179.455 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.784 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.2 OUTLIER -78.83 6.94 7.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.213 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.574 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 84.4 m-20 -130.12 83.76 2.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.89 0.376 . . . . 0.0 111.379 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.579 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.2 OUTLIER -48.27 -53.97 15.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.514 179.682 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.579 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 3.5 mmpt? -54.4 -42.21 70.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.555 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.794 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.3 OUTLIER -70.59 -34.55 72.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.805 179.21 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.592 HD22 HG13 ' B' ' 378' ' ' ILE . 7.2 mt -65.62 -63.96 0.97 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . 0.418 ' O ' ' HB3' ' B' ' 442' ' ' ALA . 44.6 t0 -54.79 -26.9 37.67 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.473 ' HB3' ' O ' ' B' ' 437' ' ' MET . 2.7 t80 -61.55 -44.0 97.83 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.499 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.42 ' CE2' ' HG2' ' B' ' 437' ' ' MET . 49.7 m-85 -69.86 -26.67 64.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.18 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' B' ' 439' ' ' ASP . . . -59.69 -48.77 80.34 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -63.36 -41.93 98.87 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.768 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.48 -34.5 76.96 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.115 0.483 . . . . 0.0 109.808 178.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.618 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.005 179.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.639 ' O ' ' HB3' ' B' ' 370' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.47 0.561 0 CA-C-O 120.814 0.34 . . . . 0.0 111.703 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.486 ' O ' ' HG3' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -44.36 -62.36 1.2 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.017 179.23 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.23 -32.95 50.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.37 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.791 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -58.0 -81.56 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.463 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.486 ' HG3' ' O ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -37.33 -44.82 0.63 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.129 0.49 . . . . 0.0 110.175 179.519 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.543 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.7 OUTLIER -57.26 -47.32 81.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.47 179.343 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.496 ' HA ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -57.71 -44.15 85.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.147 0.498 . . . . 0.0 111.159 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.753 HD23 ' N ' ' B' ' 374' ' ' LEU . 0.6 OUTLIER -59.16 -70.13 0.17 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -178.393 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . 0.469 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.0 m-85 -83.36 -32.34 26.28 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -177.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -81.56 -24.79 36.32 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -178.913 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.844 ' O ' HD13 ' B' ' 378' ' ' ILE . 2.4 mm? -117.3 -18.96 9.78 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.844 HD13 ' O ' ' B' ' 377' ' ' LEU . 1.6 mm -144.12 44.99 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.832 0.349 . . . . 0.0 111.342 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.469 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -165.43 60.56 0.24 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.692 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.62 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 22.3 p90 -63.45 -56.98 11.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.776 0.322 . . . . 0.0 110.512 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.62 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 166.7 31.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.986 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.411 ' HB3' ' CE2' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -169.81 28.85 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.856 0.36 . . . . 0.0 110.981 179.806 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.574 ' O ' ' N ' ' B' ' 385' ' ' LEU . 0.2 OUTLIER -108.12 20.34 18.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.459 179.803 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.47 ' HB3' ' HA3' ' B' ' 407' ' ' GLY . 0.6 OUTLIER 26.49 37.58 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 O-C-N 123.786 0.679 . . . . 0.0 111.689 179.597 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.863 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.5 OUTLIER -67.17 130.86 44.45 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.948 0.404 . . . . 0.0 110.544 -179.805 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.577 ' CD2' ' O ' ' B' ' 386' ' ' HIS . 5.4 p-80 -167.7 133.23 1.97 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.316 0.579 . . . . 0.0 112.194 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.918 ' CE2' ' HB1' ' B' ' 427' ' ' ALA . 34.4 m-85 -85.71 -177.25 6.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.033 178.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.542 HG23 ' O ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -160.42 111.51 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.3 0.572 . . . . 0.0 111.358 178.286 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.9 m -74.61 116.13 14.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.954 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.821 HG23 HG23 ' B' ' 401' ' ' ILE . 23.9 m -126.1 151.16 32.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.582 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.532 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 79.42 49.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.474 -179.673 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.442 ' C ' ' O ' ' B' ' 391' ' ' LYS . 36.1 mttt -32.3 127.33 0.35 Allowed Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.11 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.605 ' O ' HG22 ' B' ' 394' ' ' THR . 12.3 Cg_endo -56.8 -170.77 0.03 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.723 2.282 . . . . 0.0 112.064 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.605 HG22 ' O ' ' B' ' 393' ' ' PRO . 0.1 OUTLIER -168.33 168.3 11.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.001 -179.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -71.6 -10.22 59.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.923 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 33.5 m -128.28 12.87 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 CA-C-O 121.378 0.609 . . . . 0.0 110.104 178.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.574 ' HB3' HG23 ' B' ' 394' ' ' THR . 0.2 OUTLIER -164.24 56.68 0.52 Allowed Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.913 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.571 ' HD3' ' N ' ' B' ' 397' ' ' ASP . 50.2 Cg_exo -53.75 -19.19 14.01 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.093 2.529 . . . . 0.0 113.166 -179.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.569 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 43.9 p-10 -65.09 139.57 58.73 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 121.301 0.572 . . . . 0.0 111.474 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . 0.549 ' O ' ' HA ' ' B' ' 416' ' ' VAL . 17.6 t -137.41 161.08 37.28 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.771 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.869 HD13 ' HB ' ' B' ' 416' ' ' VAL . 4.8 tp -128.79 113.04 27.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 121.18 0.514 . . . . 0.0 111.243 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.915 ' O ' HG22 ' B' ' 414' ' ' THR . 1.9 t -79.3 164.31 3.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.846 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.542 ' O ' HG23 ' B' ' 388' ' ' VAL . 1.3 mm-40 -133.23 106.36 7.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.174 0.511 . . . . 0.0 110.812 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.543 ' SG ' ' CE2' ' B' ' 387' ' ' TYR . 2.0 t -85.9 108.59 18.23 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.481 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -140.26 151.7 45.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.072 0.463 . . . . 0.0 111.375 -179.379 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.863 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -123.35 126.78 73.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.512 -179.248 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . 0.47 ' HA3' ' HB3' ' B' ' 384' ' ' ARG . . . -28.52 -35.67 0.01 OUTLIER Glycine 0 C--N 1.331 0.277 0 CA-C-N 115.652 -0.704 . . . . 0.0 113.758 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' B' ' 406' ' ' VAL . 58.9 t0 -53.36 -20.98 5.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.231 0.539 . . . . 0.0 110.151 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 101.8 42.88 2.2 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.081 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.583 HG22 HD13 ' B' ' 412' ' ' LEU . 13.9 m -137.79 133.24 33.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.921 0.391 . . . . 0.0 111.774 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.475 ' HA ' ' O ' ' B' ' 404' ' ' CYS . 42.9 t -94.63 88.13 2.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.61 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.838 HD12 ' HG3' ' B' ' 437' ' ' MET . 0.1 OUTLIER -51.47 -13.63 0.24 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.316 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.429 ' N ' ' HB3' ' B' ' 404' ' ' CYS . . . 153.51 -165.65 31.5 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 119.62 -1.276 . . . . 0.0 113.39 178.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.915 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -142.27 173.77 11.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.75 0.31 . . . . 0.0 110.563 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.712 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -146.61 98.9 0.2 Allowed Glycine 0 C--O 1.225 -0.416 0 C-N-CA 120.324 -0.941 . . . . 0.0 112.626 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.869 ' HB ' HD13 ' B' ' 401' ' ' ILE . 13.5 p -105.45 157.46 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.893 0.347 . . . . 0.0 110.193 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.788 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . 166.63 138.13 2.37 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 119.422 -1.37 . . . . 0.0 113.496 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.541 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.1 OUTLIER -47.09 -67.41 0.28 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.005 0.431 . . . . 0.0 109.957 179.403 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.784 ' O ' ' N ' ' B' ' 421' ' ' LYS . 2.1 p-10 -85.01 91.81 8.18 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 176.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.817 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.9 OUTLIER -17.74 -31.5 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -177.411 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.784 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.6 OUTLIER -44.83 -57.05 3.99 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.831 179.011 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.788 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.2 OUTLIER -44.98 -39.44 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.569 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.579 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.817 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -63.35 -37.6 87.9 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.827 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -70.31 -65.48 2.51 Favored Glycine 0 C--N 1.334 0.45 0 C-N-CA 120.206 -0.997 . . . . 0.0 111.724 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.481 ' H ' HD12 ' B' ' 425' ' ' ILE . 3.1 mp -53.76 -35.39 26.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.228 179.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.578 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 1.7 tpt180 -61.59 -53.27 58.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.002 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.918 ' HB1' ' CE2' ' B' ' 387' ' ' TYR . . . -45.51 -45.88 13.57 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.916 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.791 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -56.54 -72.39 0.08 Allowed 'General case' 0 C--O 1.238 0.467 0 CA-C-O 121.147 0.499 . . . . 0.0 110.216 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.542 ' HA ' HD21 ' B' ' 432' ' ' LEU . 19.9 mt-10 -45.61 -25.77 0.51 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.026 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.474 ' ND2' ' HD2' ' B' ' 426' ' ' ARG . 1.3 m-80 -72.33 -34.22 67.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.218 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.682 ' HB3' HD22 ' B' ' 374' ' ' LEU . . . -65.83 -43.96 86.98 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.451 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.886 ' CA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -101.42 25.93 7.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.021 0.439 . . . . 0.0 110.645 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.515 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 20.3 ttt180 -94.4 -9.84 34.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.07 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.444 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 3.6 m-20 -109.29 95.13 5.42 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.786 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.546 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 2.5 ptmt -56.33 -31.64 63.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.5 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.546 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 5.9 mtpt -66.15 -54.86 20.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.525 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.838 ' HG3' HD12 ' B' ' 412' ' ' LEU . 17.5 tmm? -63.86 -46.94 82.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.299 179.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.886 HD11 ' CA ' ' B' ' 432' ' ' LEU . 71.4 mt -55.24 -59.05 5.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.961 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -64.49 -24.68 67.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.678 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.602 ' CE2' ' CZ ' ' B' ' 441' ' ' TYR . 0.1 OUTLIER -62.28 -47.29 84.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.134 0.493 . . . . 0.0 109.783 179.561 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.602 ' CZ ' ' CE2' ' B' ' 440' ' ' PHE . 64.9 m-85 -76.94 -41.51 42.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.153 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -44.01 -45.19 7.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.97 -45.67 66.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.288 178.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.554 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -52.32 -24.52 7.66 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.652 178.86 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.573 ' HD3' ' CD1' ' B' ' 380' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.04 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.172 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.474 ' HA ' ' NZ ' ' B' ' 371' ' ' LYS . 2.1 ttp -36.2 -52.67 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.355 179.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.46 -42.0 98.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.161 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 1.006 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -65.41 -83.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.943 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.485 ' C ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -26.67 -49.91 0.04 OUTLIER 'General case' 0 C--O 1.235 0.301 0 O-C-N 123.428 0.455 . . . . 0.0 111.053 179.769 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.476 ' O ' ' HB2' ' B' ' 376' ' ' SER . 35.7 ttp85 -54.08 -61.97 1.96 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.359 179.168 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.575 ' HG2' HD22 ' B' ' 377' ' ' LEU . 0.0 OUTLIER -47.61 -54.53 11.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 111.09 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.469 HD11 ' CB ' ' B' ' 428' ' ' ALA . 7.7 mt -42.86 -67.85 0.24 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -178.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . 0.536 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-30 -93.16 -48.3 6.53 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.476 ' HB2' ' O ' ' B' ' 372' ' ' ARG . 11.9 m -60.61 -13.94 17.37 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 121.259 -0.176 . . . . 0.0 111.338 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.778 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.9 OUTLIER -125.43 -29.12 3.26 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.235 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.778 HD13 ' O ' ' B' ' 377' ' ' LEU . 6.8 mm -142.88 44.2 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -178.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.536 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -142.48 74.77 0.33 Allowed Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.719 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.56 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 0.1 OUTLIER -100.41 -76.67 0.55 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.745 0.307 . . . . 0.0 110.803 179.876 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.56 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 168.1 82.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.008 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 25.1 t 176.58 -69.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.618 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.645 HD23 ' N ' ' B' ' 383' ' ' LEU . 1.6 pt? -41.99 -28.15 0.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.822 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' B' ' 407' ' ' GLY . 0.7 OUTLIER 62.93 53.27 2.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.748 -179.721 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.82 ' HG ' HG12 ' B' ' 406' ' ' VAL . 6.1 tt -76.7 127.6 33.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.664 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.52 ' N ' HD23 ' B' ' 385' ' ' LEU . 14.3 p-80 -152.07 140.83 20.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.52 0.676 . . . . 0.0 112.366 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.504 ' OH ' ' HA ' ' B' ' 428' ' ' ALA . 40.5 m-85 -91.89 160.65 15.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.869 179.347 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.66 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -136.97 138.25 46.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.118 179.067 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . 0.525 ' CG2' ' O ' ' B' ' 389' ' ' THR . 0.4 OUTLIER -100.08 113.49 26.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.708 -179.786 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.987 HG23 HG23 ' B' ' 401' ' ' ILE . 32.0 m -122.52 147.37 26.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.413 0.625 . . . . 0.0 111.42 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.624 ' CB ' HG22 ' B' ' 401' ' ' ILE . 9.3 tmtt? 80.55 55.97 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.961 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.444 ' C ' ' O ' ' B' ' 391' ' ' LYS . 2.8 mmtt -34.55 142.69 0.23 Allowed Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.672 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.442 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 14.6 Cg_exo -65.67 162.95 32.18 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.214 1.943 . . . . 0.0 111.845 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 22.8 p -132.29 158.99 40.43 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.855 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -82.01 7.66 12.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.517 179.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . 0.767 HG23 ' OD2' ' B' ' 397' ' ' ASP . 20.5 m -128.67 -15.72 2.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.313 178.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.767 ' OD2' HG23 ' B' ' 396' ' ' VAL . 1.3 m-20 -158.83 65.41 2.88 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.543 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.442 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 74.7 Cg_exo -40.86 -40.31 3.56 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 123.607 2.871 . . . . 0.0 114.092 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.522 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 3.0 p-10 -33.74 140.7 0.05 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.049 0.452 . . . . 0.0 111.502 -178.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 2.7 m -143.23 163.0 34.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.466 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.987 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -123.74 140.92 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 121.211 0.529 . . . . 0.0 111.557 -179.273 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.851 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -102.84 179.3 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.121 179.479 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.66 ' CB ' HG23 ' B' ' 388' ' ' VAL . 0.1 OUTLIER -149.97 108.38 3.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.024 0.44 . . . . 0.0 110.531 178.902 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.903 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 1.8 t -82.55 116.88 22.17 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.598 ' HA ' ' O ' ' B' ' 410' ' ' THR . 2.5 ptm180 -152.16 172.32 16.54 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.416 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.82 HG12 ' HG ' ' B' ' 385' ' ' LEU . 3.7 m -139.86 138.37 38.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.895 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' B' ' 384' ' ' ARG . . . -35.66 -36.83 0.12 Allowed Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 116.105 -0.498 . . . . 0.0 113.326 -179.26 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -55.55 -17.51 5.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.046 0.45 . . . . 0.0 110.382 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 95.66 45.81 2.85 Favored Glycine 0 N--CA 1.445 -0.718 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.625 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.699 ' HB ' HG22 ' B' ' 406' ' ' VAL . 37.4 m -131.55 112.59 12.76 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 -179.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' B' ' 404' ' ' CYS . 30.4 t -84.43 86.64 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.416 179.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.762 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.0 OUTLIER -46.36 -23.1 0.31 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.98 -179.528 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.27 -154.51 25.4 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.042 -1.075 . . . . 0.0 113.383 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.676 HG22 HD11 ' B' ' 401' ' ' ILE . 3.3 m -155.99 154.64 31.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.73 -0.235 . . . . 0.0 110.472 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.648 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -139.94 160.81 26.28 Favored Glycine 0 C--O 1.224 -0.523 0 C-N-CA 119.691 -1.242 . . . . 0.0 113.981 -179.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.402 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 1.4 p -146.52 145.57 19.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.694 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -161.69 132.71 2.92 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.061 -1.066 . . . . 0.0 113.246 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.518 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 6.6 ttm180 -54.33 -53.58 51.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.948 0.404 . . . . 0.0 110.896 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.849 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.1 OUTLIER -79.48 -15.88 57.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.136 179.343 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.849 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 93.23 -42.69 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.159 0 C-N-CA 123.434 0.693 . . . . 0.0 111.536 -179.514 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.577 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.1 OUTLIER -52.63 -45.89 66.82 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.01 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.778 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -52.95 -36.58 24.17 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.691 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 177.648 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.851 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -66.75 -43.4 84.23 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.556 178.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.87 -64.95 3.3 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.258 -0.972 . . . . 0.0 111.144 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.548 ' O ' ' HB3' ' B' ' 428' ' ' ALA . 53.6 mt -52.97 -41.54 41.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.852 0.358 . . . . 0.0 110.471 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.598 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 6.4 tpt180 -57.66 -55.86 29.37 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.495 ' HA ' ' OD1' ' B' ' 430' ' ' ASN . . . -40.81 -44.88 2.34 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 1.006 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -53.04 -62.96 1.31 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.648 178.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.467 ' HA ' HD11 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -48.29 -31.83 6.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.35 179.117 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.495 ' OD1' ' HA ' ' B' ' 427' ' ' ALA . 9.1 m120 -67.56 -31.69 71.93 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.785 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.903 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -70.96 -48.26 54.38 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.763 0.316 . . . . 0.0 110.643 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.928 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -89.94 14.38 12.31 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.756 179.486 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.53 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 8.6 ttt-85 -86.08 3.28 43.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.426 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.513 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 3.7 t70 -126.5 92.39 3.55 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.115 0.484 . . . . 0.0 111.011 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.536 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -55.86 -32.88 64.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.668 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.536 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 15.6 mtmm -66.92 -59.22 3.7 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.518 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.762 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.9 OUTLIER -55.53 -51.78 65.89 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.286 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.928 HD11 ' HA ' ' B' ' 432' ' ' LEU . 96.0 mt -53.58 -65.65 0.53 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 178.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -42.09 -37.56 1.44 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.366 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.533 ' C ' ' CD1' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -63.81 -42.77 97.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.633 179.439 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.559 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 50.4 m-85 -71.91 -35.8 69.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.262 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.72 -48.37 63.62 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -38.59 90.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.628 178.479 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.559 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -64.96 -23.16 67.14 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.233 179.516 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.525 ' CZ ' ' HB3' ' B' ' 380' ' ' TYR . 13.7 tpt180 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.143 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.524 ' HA ' HG23 ' B' ' 425' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.236 0.361 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.487 ' HA ' ' HD2' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -29.94 -65.06 0.11 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.947 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . 0.453 ' CG ' ' CE ' ' B' ' 368' ' ' MET . 2.9 m120 -42.27 -49.22 5.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.798 0.332 . . . . 0.0 110.486 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.822 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -58.95 -79.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.42 179.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.487 ' HD2' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -36.22 -40.97 0.24 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.086 0.47 . . . . 0.0 110.17 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.539 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.2 tmm_? -59.4 -63.52 1.27 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.278 179.221 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.62 ' HB3' HD22 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -45.56 -34.98 3.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.394 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.758 HD11 ' HA ' ' B' ' 428' ' ' ALA . 1.3 mt -68.44 -76.73 0.09 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . 0.523 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.9 m-30 -84.91 21.58 1.56 Allowed 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.118 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -131.02 -36.7 1.32 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.731 0.3 . . . . 0.0 111.04 179.706 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.653 ' O ' HD13 ' B' ' 378' ' ' ILE . 2.1 mp -102.89 -27.55 12.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.161 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.653 HD13 ' O ' ' B' ' 377' ' ' LEU . 3.6 mm -139.91 37.43 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.134 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.444 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.523 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -126.52 93.36 0.4 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.351 -0.928 . . . . 0.0 112.909 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.475 ' CD2' ' HG2' ' B' ' 445' ' ' ARG . 42.8 p90 -105.43 -169.72 1.64 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.712 0.292 . . . . 0.0 110.291 179.335 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.613 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -87.19 109.41 19.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.26 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.613 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 10.7 t 104.1 37.26 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.755 0.66 . . . . 0.0 111.782 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.541 ' CD1' ' O ' ' B' ' 378' ' ' ILE . 2.8 tt -87.43 -49.43 7.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.11 0.481 . . . . 0.0 110.056 179.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.479 ' HB3' ' HA3' ' B' ' 407' ' ' GLY . 0.0 OUTLIER 72.08 35.7 1.24 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.406 178.758 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.633 HD12 HG12 ' B' ' 406' ' ' VAL . 0.3 OUTLIER -40.21 140.8 0.56 Allowed 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.617 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.556 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 1.4 t60 -128.24 83.31 2.15 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 -178.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.591 ' CE1' ' SG ' ' B' ' 404' ' ' CYS . 3.9 m-85 -83.84 116.98 23.0 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.104 177.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.82 113.78 44.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.9 0.381 . . . . 0.0 111.074 -179.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 54.3 m -77.37 127.92 33.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.348 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.773 HG23 HG23 ' B' ' 401' ' ' ILE . 31.8 m -134.6 151.54 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.097 0.475 . . . . 0.0 111.448 -179.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.503 ' HB3' ' O ' ' B' ' 390' ' ' VAL . 10.7 tppt? 83.31 54.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.952 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.444 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 0.0 OUTLIER -34.95 142.83 0.24 Allowed Pre-proline 0 C--N 1.332 -0.153 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.415 179.842 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.502 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 2.7 Cg_exo -74.3 155.54 46.36 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 122.34 2.027 . . . . 0.0 113.434 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.487 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 1.7 p -138.69 165.96 25.61 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.507 -1.224 . . . . 0.0 111.762 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -86.89 12.9 9.99 Favored 'General case' 0 CA--C 1.527 0.088 0 CA-C-O 121.33 0.586 . . . . 0.0 110.276 178.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 3.7 m -138.52 18.91 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.507 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.442 ' H ' ' CD ' ' B' ' 398' ' ' PRO . 0.8 OUTLIER 162.77 55.82 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.28 -179.538 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.502 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 3.9 Cg_endo -46.52 -48.79 13.0 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 123.623 2.882 . . . . 0.0 112.745 -179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.579 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -32.57 130.28 0.18 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.028 -178.814 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 13.8 m -132.58 159.51 39.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.392 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.773 HG23 HG23 ' B' ' 390' ' ' VAL . 16.8 tt -117.32 164.79 13.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.962 0.41 . . . . 0.0 111.221 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.609 HG23 ' O ' ' B' ' 415' ' ' GLY . 0.2 OUTLIER -135.69 138.67 47.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.013 -179.001 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.494 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 6.5 mt-10 -101.35 126.15 48.07 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.591 ' SG ' ' CE1' ' B' ' 387' ' ' TYR . 19.0 t -109.03 102.35 11.34 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.883 ' HB3' HG22 ' B' ' 411' ' ' VAL . 17.9 ptt180 -143.45 111.47 6.12 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.352 0.596 . . . . 0.0 111.485 -178.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.826 HG13 HD21 ' B' ' 412' ' ' LEU . 10.2 m -59.05 150.3 5.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.597 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . 0.479 ' HA3' ' HB3' ' B' ' 384' ' ' ARG . . . -52.5 -15.72 3.13 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.003 -0.999 . . . . 0.0 113.908 -179.129 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.14 -2.92 14.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.794 0.33 . . . . 0.0 110.564 179.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 86.74 41.79 6.66 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.618 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.547 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 21.5 m -140.72 125.37 17.95 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.803 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.883 HG22 ' HB3' ' B' ' 405' ' ' ARG . 54.9 t -87.46 112.58 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.309 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.826 HD21 HG13 ' B' ' 406' ' ' VAL . 1.2 mm? -67.75 -41.02 84.03 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . -177.42 -149.05 7.61 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.573 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.494 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -151.08 173.94 13.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.733 0.301 . . . . 0.0 110.906 -179.803 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.609 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -162.09 122.65 1.12 Allowed Glycine 0 C--O 1.227 -0.327 0 C-N-CA 120.186 -1.007 . . . . 0.0 113.066 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.412 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 6.4 p -126.67 149.42 31.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.805 0.336 . . . . 0.0 110.606 179.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.932 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -163.5 158.08 30.42 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.024 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . . . . . . . . . 8.8 ptt180 -63.2 -42.26 99.28 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.859 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.9 OUTLIER -101.46 30.15 4.41 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 179.418 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.745 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.55 -43.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 115.37 1.618 . . . . 0.0 115.37 178.402 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.624 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -48.91 -47.29 43.49 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.711 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.932 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -49.45 -38.34 12.33 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.541 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.745 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -61.92 -48.32 80.98 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.627 178.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.478 ' HA2' HG21 ' B' ' 402' ' ' VAL . . . -63.33 -65.36 3.13 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.319 -0.943 . . . . 0.0 111.404 179.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.524 HG23 ' HA ' ' B' ' 367' ' ' ASP . 0.8 OUTLIER -50.37 -32.76 9.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.893 0.377 . . . . 0.0 109.994 178.925 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.593 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 27.6 tpt180 -65.46 -48.07 73.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.929 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.526 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -48.91 -42.1 35.83 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.822 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -58.07 -60.1 4.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.707 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.479 ' O ' ' HG ' ' B' ' 432' ' ' LEU . 14.6 mm-40 -48.73 -33.09 9.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.012 179.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.494 ' ND2' ' O ' ' B' ' 414' ' ' THR . 1.2 m-80 -65.02 -39.08 92.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.289 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.53 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -62.33 -41.75 98.81 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.156 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.686 HD23 HD21 ' B' ' 374' ' ' LEU . 0.3 OUTLIER -87.33 0.37 55.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.795 179.414 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' B' ' 433' ' ' ARG . 54.8 ttt-85 -88.28 16.45 6.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.977 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.438 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 9.6 m-20 -129.21 76.54 1.73 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.131 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.5 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -51.4 -32.54 26.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.097 0.475 . . . . 0.0 109.87 179.524 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.5 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -69.82 -42.37 73.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.092 179.642 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.489 ' HE2' HD12 ' B' ' 412' ' ' LEU . 13.2 tmm? -76.89 -44.73 30.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.027 179.243 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.634 HD11 ' HA ' ' B' ' 432' ' ' LEU . 68.1 mt -52.84 -67.69 0.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -53.36 -42.66 67.08 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.681 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.5 ' HB3' ' O ' ' B' ' 436' ' ' LYS . 2.5 t80 -53.7 -32.52 52.19 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.544 ' OH ' HG21 ' B' ' 406' ' ' VAL . 3.7 m-85 -78.7 -30.37 46.01 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.03 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -52.87 -39.52 62.69 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 177.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.15 -42.09 60.49 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.248 177.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.539 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -63.21 -13.8 41.73 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.406 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.475 ' HG2' ' CD2' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.191 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.665 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.547 ' N ' ' OD1' ' B' ' 367' ' ' ASP . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.329 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.501 ' N ' ' HE2' ' B' ' 371' ' ' LYS . 10.8 ptm -34.74 -43.14 0.17 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.407 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -64.08 -49.85 70.66 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.024 0.44 . . . . 0.0 109.83 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.657 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -53.73 -78.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.107 179.042 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.501 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -32.5 -50.69 0.25 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.091 -179.587 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.541 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -51.96 -45.42 64.4 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.413 179.766 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.546 ' HA ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -58.93 -52.08 67.27 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.366 0.603 . . . . 0.0 110.898 179.775 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.719 HD23 ' N ' ' B' ' 374' ' ' LEU . 1.5 mt -53.68 -73.85 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -82.65 -33.67 27.73 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.541 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -82.1 -16.38 50.18 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.111 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.546 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.4 OUTLIER -120.19 -24.77 5.87 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.357 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.679 HG22 ' CD1' ' B' ' 383' ' ' LEU . 27.7 mm -124.13 -65.83 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 C-N-CA 120.796 -0.362 . . . . 0.0 111.949 -179.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' B' ' 374' ' ' LEU . . . -56.29 79.06 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.459 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.696 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 2.5 p90 -60.55 -41.46 94.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.498 0.19 . . . . 0.0 111.169 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.696 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 154.99 -20.3 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.893 0.378 . . . . 0.0 111.169 179.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 1.7 m -127.29 39.62 3.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.69 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.679 ' CD1' HG22 ' B' ' 378' ' ' ILE . 0.5 OUTLIER -99.2 -36.3 9.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.068 -179.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 76.52 48.27 0.07 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.051 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.669 ' HA ' HG12 ' B' ' 406' ' ' VAL . 9.6 tt -89.39 143.11 27.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.56 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.406 ' NE2' ' HG3' ' B' ' 405' ' ' ARG . 14.3 p-80 -164.12 138.27 5.57 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.481 0.658 . . . . 0.0 112.576 -179.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.624 ' HE1' HD21 ' B' ' 385' ' ' LEU . 15.2 m-85 -98.48 142.14 30.46 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.077 178.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.786 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -122.29 116.72 49.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.896 -179.793 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 18.2 m -60.0 85.99 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 177.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.983 HG13 HG23 ' B' ' 401' ' ' ILE . 1.6 p -83.43 132.15 32.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.25 -0.887 . . . . 0.0 111.448 -177.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.537 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.9 OUTLIER 90.88 132.88 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.546 -178.348 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.488 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 1.5 mmmm -85.56 123.06 73.19 Favored Pre-proline 0 N--CA 1.464 0.244 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.343 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.488 ' HD3' ' HA ' ' B' ' 392' ' ' LYS . 2.9 Cg_exo -74.64 164.07 34.53 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.979 2.453 . . . . 0.0 113.357 -179.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.436 HG23 ' O ' ' B' ' 397' ' ' ASP . 0.6 OUTLIER -107.74 -158.74 0.66 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.342 179.769 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -89.13 -48.53 7.33 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.551 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . 0.515 ' C ' ' CD ' ' B' ' 398' ' ' PRO . 2.7 m -111.74 -13.1 11.38 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-O 121.658 0.742 . . . . 0.0 110.266 179.161 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.564 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 0.8 OUTLIER -115.44 44.95 0.39 Allowed Pre-proline 0 C--N 1.318 -0.776 0 CA-C-N 114.53 -1.213 . . . . 0.0 110.966 179.888 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' B' ' 397' ' ' ASP . 13.7 Cg_exo -45.67 -22.21 1.09 Allowed 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.533 2.156 . . . . 0.0 112.062 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' B' ' 398' ' ' PRO . 0.2 OUTLIER -20.26 88.64 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.295 0 O-C-N 123.665 0.603 . . . . 0.0 111.233 179.997 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . 0.479 ' N ' ' O ' ' B' ' 398' ' ' PRO . 18.0 t -119.21 159.87 23.23 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.283 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.983 HG23 HG13 ' B' ' 390' ' ' VAL . 13.6 tt -112.26 160.61 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-O 121.476 0.655 . . . . 0.0 111.003 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.789 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.4 OUTLIER -120.25 142.04 37.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.786 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.786 ' CB ' HG23 ' B' ' 388' ' ' VAL . 0.3 OUTLIER -106.11 121.33 43.94 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.461 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.565 ' O ' ' N ' ' B' ' 412' ' ' LEU . 2.6 m -101.76 105.93 16.87 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.49 ' HA ' ' O ' ' B' ' 410' ' ' THR . 1.6 ptm180 -138.01 -179.94 6.07 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.364 0.602 . . . . 0.0 112.357 -178.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.684 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -148.63 139.75 17.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.02 -179.431 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . 0.465 ' O ' ' CG ' ' B' ' 408' ' ' ASP . . . 56.29 16.29 14.06 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.15 -1.024 . . . . 0.0 110.737 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . 0.47 ' O ' ' OD1' ' B' ' 408' ' ' ASP . 1.9 p30 55.29 32.98 19.74 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.226 0.536 . . . . 0.0 110.336 -179.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -140.26 -26.64 0.23 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.517 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.684 ' HB ' HG23 ' B' ' 406' ' ' VAL . 44.6 m -121.24 110.92 16.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 117.143 0.471 . . . . 0.0 112.226 -179.234 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.484 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 60.1 t -86.53 111.63 21.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.336 178.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.815 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.3 OUTLIER -66.85 -37.74 85.03 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.248 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . -178.67 -143.44 5.25 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.452 -0.88 . . . . 0.0 112.408 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.792 ' OG1' HD11 ' B' ' 401' ' ' ILE . 11.5 t -176.1 170.1 2.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.557 0.218 . . . . 0.0 110.886 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.489 ' O ' HG13 ' B' ' 401' ' ' ILE . . . -161.18 146.43 12.29 Favored Glycine 0 C--O 1.226 -0.398 0 C-N-CA 120.348 -0.929 . . . . 0.0 112.804 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.845 HG22 ' HB ' ' B' ' 401' ' ' ILE . 54.7 t -121.34 155.05 25.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.813 0.339 . . . . 0.0 110.704 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.903 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -165.05 141.32 6.97 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.128 -1.034 . . . . 0.0 113.117 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.474 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -63.62 -41.54 98.27 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.722 0.296 . . . . 0.0 111.047 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.839 ' H ' HD11 ' B' ' 422' ' ' ILE . 8.6 p30 -102.47 29.68 5.09 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.684 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 47.81 -44.42 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 178.629 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.604 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -48.37 -48.95 36.31 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 119.116 0.871 . . . . 0.0 108.676 -179.398 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.903 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.52 -38.21 5.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.533 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.789 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -66.29 -43.2 86.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.493 178.163 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.48 -67.25 2.14 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.774 -0.727 . . . . 0.0 111.978 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.441 HG12 ' HG2' ' B' ' 421' ' ' LYS . 5.0 mm -50.25 -59.38 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.825 0.345 . . . . 0.0 111.205 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.586 ' HG3' ' N ' ' B' ' 427' ' ' ALA . 0.0 OUTLIER -49.36 -44.47 44.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.21 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.586 ' N ' ' HG3' ' B' ' 426' ' ' ARG . . . -47.4 -51.67 19.11 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.657 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -52.22 -50.9 61.04 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.828 179.15 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.496 ' HA ' ' CG ' ' B' ' 432' ' ' LEU . 40.2 mt-10 -56.22 -34.16 66.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.882 179.023 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.4 OUTLIER -59.91 -41.06 90.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.461 179.344 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.435 ' HB2' ' OH ' ' B' ' 387' ' ' TYR . . . -64.13 -42.55 96.77 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.234 0.54 . . . . 0.0 110.295 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.705 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.3 OUTLIER -84.26 7.03 20.54 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.482 179.328 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 10.0 mtt180 -94.86 14.3 21.95 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.084 0.468 . . . . 0.0 110.969 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.554 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 67.4 m-20 -125.73 78.27 1.73 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.821 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.553 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 8.6 ptpt -46.85 -53.55 11.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.047 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.553 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.3 mttt -55.65 -40.54 72.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 0.0 110.695 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.815 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.1 OUTLIER -71.91 -46.7 56.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.317 179.546 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.705 HD11 ' HA ' ' B' ' 432' ' ' LEU . 72.2 mt -57.95 -61.69 2.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.002 179.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -54.27 -33.23 58.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.906 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' B' ' 437' ' ' MET . 5.8 t80 -59.21 -38.57 80.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.493 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.625 ' CE1' HD21 ' B' ' 383' ' ' LEU . 53.2 m-85 -79.42 -27.2 41.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.112 179.029 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -59.66 -52.48 65.35 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.9 -47.17 86.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 177.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.486 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -59.82 -17.01 32.76 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.15 178.591 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.196 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.343 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.663 ' O ' ' HB3' ' B' ' 370' ' ' ALA . 3.4 p30 . . . . . 0 C--O 1.236 0.364 0 CA-C-O 120.919 0.39 . . . . 0.0 110.965 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.542 ' HE3' ' N ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -54.37 -55.16 31.34 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.824 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . 0.542 ' N ' ' HE3' ' B' ' 368' ' ' MET . 16.1 m120 -55.18 -37.74 67.44 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.663 ' HB3' ' O ' ' B' ' 367' ' ' ASP . . . -49.87 -78.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.746 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -41.68 -42.16 2.45 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.33 0.586 . . . . 0.0 109.939 179.606 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.557 ' O ' ' CB ' ' B' ' 376' ' ' SER . 13.7 ttp180 -55.64 -46.82 77.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.484 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.563 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -57.29 -47.07 82.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.437 0.637 . . . . 0.0 110.49 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.755 HD23 ' N ' ' B' ' 374' ' ' LEU . 1.3 mt -51.63 -70.57 0.08 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.58 -179.029 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . 0.449 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.3 m-85 -84.97 -42.08 15.27 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -177.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.9 OUTLIER -65.41 -29.3 69.98 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.563 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 4.3 mm? -110.94 -44.58 3.59 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.886 -179.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.549 HG13 ' CD2' ' B' ' 438' ' ' LEU . 0.9 OUTLIER -118.45 51.59 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.983 0.421 . . . . 0.0 111.432 -179.185 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.449 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -140.22 44.6 1.05 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.219 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.697 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 23.5 p90 -91.03 -45.93 8.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.678 0.275 . . . . 0.0 111.169 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.697 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 160.85 -168.0 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.266 0.555 . . . . 0.0 111.638 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 5.7 t 43.91 22.27 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.562 -0.745 . . . . 0.0 112.083 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.769 ' CD1' HD12 ' B' ' 385' ' ' LEU . 2.0 pt? -127.39 -0.49 6.3 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.485 ' HB2' ' HA2' ' B' ' 407' ' ' GLY . 1.3 mmt180 29.95 49.48 0.06 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.344 179.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.769 HD12 ' CD1' ' B' ' 383' ' ' LEU . 0.4 OUTLIER -59.94 129.76 43.39 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 121.073 0.464 . . . . 0.0 111.411 -179.505 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.581 ' CD2' ' O ' ' B' ' 386' ' ' HIS . 24.0 p-80 -167.79 108.88 0.59 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.154 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.511 ' HA ' ' HA ' ' B' ' 404' ' ' CYS . 2.8 m-85 -55.76 175.55 0.08 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.149 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.42 ' N ' ' O ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -157.54 101.87 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.743 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 31.4 m -77.18 106.32 8.83 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.661 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.723 HG23 HG23 ' B' ' 401' ' ' ILE . 28.4 m -112.42 150.43 14.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 0.0 110.678 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.654 ' HB3' HG22 ' B' ' 401' ' ' ILE . 8.2 tppt? 72.44 48.97 0.22 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.38 -179.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' B' ' 391' ' ' LYS . 2.2 mtmt -33.79 143.64 0.18 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.194 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.468 ' O ' HG22 ' B' ' 394' ' ' THR . 32.3 Cg_exo -58.23 179.98 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.954 2.436 . . . . 0.0 112.499 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.532 ' OG1' ' N ' ' B' ' 397' ' ' ASP . 0.1 OUTLIER -160.84 155.42 23.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.089 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -59.24 -23.27 62.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.138 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 2.8 m -123.96 13.44 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.234 0.54 . . . . 0.0 110.264 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.541 ' N ' ' HD3' ' B' ' 398' ' ' PRO . 0.8 OUTLIER -157.51 51.96 0.53 Allowed Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.468 179.645 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.541 ' HD3' ' N ' ' B' ' 397' ' ' ASP . 85.4 Cg_exo -46.65 -29.02 7.14 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.788 2.325 . . . . 0.0 112.396 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.498 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 20.8 p-10 -53.27 132.0 38.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.258 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -135.37 144.33 46.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.123 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 1.03 HD12 ' O ' ' B' ' 415' ' ' GLY . 0.6 OUTLIER -107.29 100.17 10.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-O 121.213 0.53 . . . . 0.0 111.223 -179.463 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.819 HG23 ' HB1' ' B' ' 423' ' ' ALA . 0.4 OUTLIER -72.39 163.2 4.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.048 179.716 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.513 ' HG2' ' N ' ' B' ' 404' ' ' CYS . 44.9 tt0 -148.9 158.49 44.21 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.79 ' O ' ' O ' ' B' ' 411' ' ' VAL . 24.3 t -132.49 130.72 40.83 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 178.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -129.79 126.99 39.43 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 123.697 0.623 . . . . 0.0 110.776 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.718 ' CG2' HD22 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -124.64 134.23 67.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.516 -179.287 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . 0.485 ' HA2' ' HB2' ' B' ' 384' ' ' ARG . . . 64.18 5.78 17.06 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.754 -0.736 . . . . 0.0 111.866 -179.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 66.48 68.61 0.43 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 163.87 -46.51 0.31 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.113 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.589 ' HB ' HG23 ' B' ' 406' ' ' VAL . 12.0 m -86.78 113.47 22.64 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.79 ' O ' ' O ' ' B' ' 404' ' ' CYS . 3.9 t -76.6 -60.93 1.91 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 -177.026 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.735 ' HG ' ' HE2' ' B' ' 437' ' ' MET . 0.1 OUTLIER 63.9 -39.2 0.21 Allowed 'General case' 0 C--N 1.315 -0.893 0 O-C-N 120.144 -1.598 . . . . 0.0 111.569 -178.51 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.587 ' HA2' ' HB3' ' B' ' 430' ' ' ASN . . . -112.97 127.5 7.97 Favored Glycine 0 C--N 1.35 1.326 0 C-N-CA 119.511 -1.328 . . . . 0.0 113.774 -179.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.523 ' N ' ' OD1' ' B' ' 430' ' ' ASN . 0.2 OUTLIER -165.84 63.16 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.709 0.29 . . . . 0.0 111.295 179.431 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 1.03 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -109.82 172.81 16.18 Favored Glycine 0 C--O 1.226 -0.368 0 C-N-CA 120.407 -0.901 . . . . 0.0 113.667 -178.411 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.463 HG22 ' H ' ' B' ' 417' ' ' GLY . 5.7 p -131.96 166.76 28.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.583 0.23 . . . . 0.0 110.628 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.75 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -172.81 116.25 0.6 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.092 -1.052 . . . . 0.0 113.184 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.489 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -43.69 -68.2 0.22 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.713 0.292 . . . . 0.0 110.386 179.324 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.893 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.2 OUTLIER -66.6 -20.57 66.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.039 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.893 HG23 ' O ' ' B' ' 419' ' ' ASN . 1.1 pp 102.29 -39.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 124.387 1.075 . . . . 0.0 111.37 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -49.63 -52.04 33.49 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.75 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.75 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.49 -33.27 2.96 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.519 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 177.417 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.819 ' HB1' HG23 ' B' ' 402' ' ' VAL . . . -74.22 -34.44 63.69 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.478 179.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -70.58 -56.24 7.71 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.149 -1.024 . . . . 0.0 111.152 178.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.574 ' O ' ' HB3' ' B' ' 428' ' ' ALA . 3.5 mp -63.77 -42.93 97.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.729 0.299 . . . . 0.0 110.446 179.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.576 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 17.8 tpt180 -53.51 -53.01 57.59 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.596 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -51.57 -40.23 59.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.574 ' HB3' ' O ' ' B' ' 425' ' ' ILE . . . -52.49 -74.21 0.04 OUTLIER 'General case' 0 C--O 1.236 0.393 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.551 ' HA ' ' HG ' ' B' ' 432' ' ' LEU . 3.3 mt-10 -43.04 -36.28 1.55 Allowed 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.587 ' HB3' ' HA2' ' B' ' 413' ' ' GLY . 0.3 OUTLIER -53.2 -36.86 61.42 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.263 178.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.568 ' O ' ' HE1' ' B' ' 437' ' ' MET . . . -83.51 -18.96 36.67 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 120.911 0.386 . . . . 0.0 110.782 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.596 HD22 ' HA ' ' B' ' 370' ' ' ALA . 0.8 OUTLIER -115.81 21.58 13.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.177 0.513 . . . . 0.0 109.965 178.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' B' ' 429' ' ' GLU . 38.0 mtt-85 -109.63 3.15 20.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.043 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.454 ' OD2' ' HA ' ' B' ' 412' ' ' LEU . 43.8 m-20 -106.37 77.07 1.18 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.303 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.539 ' HG3' ' N ' ' B' ' 436' ' ' LYS . 5.5 ptpp? -38.89 -48.08 1.51 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.558 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.539 ' N ' ' HG3' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -57.57 -51.56 68.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.043 -179.716 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.735 ' HE2' ' HG ' ' B' ' 412' ' ' LEU . 15.4 tmm? -61.43 -56.59 18.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.146 0.498 . . . . 0.0 110.0 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.549 ' CD2' HG13 ' B' ' 378' ' ' ILE . 60.4 mt -47.81 -64.77 0.7 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.882 178.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -54.92 -25.22 27.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.465 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.474 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -69.83 -39.08 76.67 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.362 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.555 ' HA ' ' HB2' ' B' ' 444' ' ' GLN . 32.4 m-85 -76.01 -51.97 11.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.174 179.118 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' B' ' 445' ' ' ARG . . . -44.45 -46.31 9.56 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -40.06 91.59 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.555 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -68.64 -7.18 30.77 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.49 178.917 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.589 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.411 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.621 ' O ' ' HB3' ' B' ' 370' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.162 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.575 ' CE ' ' HB3' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -48.14 -48.95 33.86 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.981 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . 0.575 ' HB3' ' CE ' ' B' ' 368' ' ' MET . 0.5 OUTLIER -66.12 -25.72 67.12 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 178.786 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' B' ' 367' ' ' ASP . . . -58.99 -70.7 0.14 Allowed 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.47 ' HD2' ' O ' ' B' ' 367' ' ' ASP . 0.1 OUTLIER -48.74 -33.27 9.91 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.317 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.548 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -58.88 -46.64 87.33 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.867 -1.061 . . . . 0.0 109.959 178.839 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.698 ' NE2' HD22 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -63.02 -45.54 91.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.497 -179.785 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.836 HD22 ' HB3' ' B' ' 431' ' ' ALA . 0.4 OUTLIER -57.55 -69.52 0.16 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -178.118 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -83.93 -33.97 24.57 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -177.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.8 ' C ' HD22 ' B' ' 377' ' ' LEU . 0.2 OUTLIER -81.97 -21.25 37.26 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.601 -0.44 . . . . 0.0 112.152 -178.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.822 ' O ' HD13 ' B' ' 378' ' ' ILE . 2.3 mm? -123.83 -6.59 7.93 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.603 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.822 HD13 ' O ' ' B' ' 377' ' ' LEU . 9.3 mm -145.6 -117.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 119.341 -0.361 . . . . 0.0 111.411 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.527 ' C ' ' O ' ' B' ' 378' ' ' ILE . . . -0.68 68.28 0.0 OUTLIER Glycine 0 C--N 1.346 1.096 0 N-CA-C 114.393 0.517 . . . . 0.0 114.393 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.596 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 0.1 OUTLIER -82.58 -78.07 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.02 0.438 . . . . 0.0 111.494 -179.764 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.596 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 164.36 50.28 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.091 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -147.34 6.55 0.86 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.623 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.66 ' H ' HD13 ' B' ' 383' ' ' LEU . 0.0 OUTLIER -152.42 18.51 0.63 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.179 0.514 . . . . 0.0 110.77 179.834 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 32.77 73.56 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.671 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.882 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.2 OUTLIER -59.52 114.17 2.57 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 177.791 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -122.2 102.46 8.15 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -176.157 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.778 ' OH ' ' HB2' ' B' ' 431' ' ' ALA . 13.2 m-85 -76.43 165.37 24.92 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 175.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.84 HG23 ' O ' ' B' ' 403' ' ' GLU . 0.2 OUTLIER -148.52 167.95 3.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 C-N-CA 120.131 -0.628 . . . . 0.0 111.003 178.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 7.7 m -130.54 118.12 20.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.92 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.926 HG23 HG23 ' B' ' 401' ' ' ILE . 20.3 m -130.03 153.4 38.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.799 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.504 ' HB3' HG22 ' B' ' 401' ' ' ILE . 0.1 OUTLIER 65.61 61.24 0.69 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.22 -179.779 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.19 139.19 56.08 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.472 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.577 ' HA ' ' HA ' ' B' ' 398' ' ' PRO . 11.0 Cg_endo -56.25 -172.89 0.04 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.574 2.183 . . . . 0.0 112.311 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.564 ' O ' ' HB2' ' B' ' 395' ' ' ALA . 54.9 p -157.02 -81.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.298 -0.41 . . . . 0.0 112.071 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . 0.564 ' HB2' ' O ' ' B' ' 394' ' ' THR . . . 167.76 -25.3 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 -179.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -116.22 -2.51 10.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.556 0.693 . . . . 0.0 110.16 178.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.438 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 1.3 m-20 179.06 56.39 0.06 OUTLIER Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.638 179.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.577 ' HA ' ' HA ' ' B' ' 393' ' ' PRO . 10.4 Cg_endo -54.57 -77.31 0.02 OUTLIER 'Trans proline' 0 CA--C 1.519 -0.251 0 C-N-CA 123.252 2.635 . . . . 0.0 112.884 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.55 ' O ' ' O ' ' B' ' 398' ' ' PRO . 0.4 OUTLIER 44.84 115.43 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.142 -179.542 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . 0.477 ' HB3' ' HA ' ' B' ' 420' ' ' ILE . 2.0 t -113.21 117.33 31.58 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.733 179.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.926 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -108.04 106.61 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 CA-C-O 121.305 0.574 . . . . 0.0 110.663 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.807 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.3 OUTLIER -77.96 158.58 4.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.099 179.756 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.84 ' O ' HG23 ' B' ' 388' ' ' VAL . 7.2 tp10 -128.78 89.48 2.89 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.191 178.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.728 ' O ' ' O ' ' B' ' 411' ' ' VAL . 0.4 OUTLIER -82.42 114.83 21.13 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 178.076 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.528 ' HA ' ' O ' ' B' ' 411' ' ' VAL . 17.5 ptt85 -155.8 169.42 24.42 Favored 'General case' 0 C--O 1.226 -0.154 0 O-C-N 124.224 0.952 . . . . 0.0 109.744 -178.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 1.051 HG13 HD21 ' B' ' 412' ' ' LEU . 23.7 m -127.27 126.43 67.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.829 0.347 . . . . 0.0 111.772 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -35.05 -33.9 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 CA-C-N 115.709 -0.678 . . . . 0.0 113.314 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' B' ' 406' ' ' VAL . 15.1 t0 -59.47 -29.19 67.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.975 0.417 . . . . 0.0 110.675 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 118.03 47.26 0.44 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 121.038 -0.601 . . . . 0.0 111.769 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.625 ' HB ' HG22 ' B' ' 406' ' ' VAL . 0.2 OUTLIER -142.45 112.68 7.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.727 0.298 . . . . 0.0 111.402 -179.241 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.728 ' O ' ' O ' ' B' ' 404' ' ' CYS . 20.8 t -59.17 -63.7 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 1.051 HD21 HG13 ' B' ' 406' ' ' VAL . 0.0 OUTLIER 86.09 -42.55 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 O-C-N 121.485 -0.759 . . . . 0.0 109.31 -178.336 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.518 ' O ' ' CB ' ' B' ' 404' ' ' CYS . . . 167.46 175.15 37.15 Favored Glycine 0 C--N 1.339 0.736 0 C-N-CA 119.61 -1.281 . . . . 0.0 113.742 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.49 ' OG1' ' N ' ' B' ' 415' ' ' GLY . 0.0 OUTLIER -142.63 -177.64 5.39 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.481 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.784 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -158.07 117.34 0.77 Allowed Glycine 0 C--O 1.223 -0.555 0 C-N-CA 118.742 -1.694 . . . . 0.0 114.273 -179.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.462 ' HA ' ' O ' ' B' ' 400' ' ' SER . 38.3 t -107.45 145.07 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 178.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.595 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -166.91 145.94 10.36 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 119.531 -1.319 . . . . 0.0 113.467 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -53.31 36.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 110.653 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.901 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.5 OUTLIER -79.73 -21.83 44.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.24 179.512 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.901 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.8 OUTLIER 99.07 -41.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 C-N-CA 124.038 0.935 . . . . 0.0 111.429 -179.215 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.592 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -50.32 -42.2 52.39 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.436 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.63 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -56.72 -37.23 51.97 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.656 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 177.717 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.807 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -71.42 -31.55 67.37 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.145 179.061 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -71.39 -67.14 1.95 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.199 -1.001 . . . . 0.0 111.168 178.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.587 HD13 ' HG2' ' B' ' 421' ' ' LYS . 2.9 mp -51.66 -46.65 38.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 121.068 0.461 . . . . 0.0 110.207 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.566 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.4 tpt180 -54.25 -43.56 71.03 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.217 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.47 ' HB1' ' HE2' ' B' ' 387' ' ' TYR . . . -52.62 -49.99 63.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.175 179.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' B' ' 431' ' ' ALA . . . -54.75 -72.2 0.07 Allowed 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.22 0.533 . . . . 0.0 110.11 179.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.522 ' HG3' ' HB2' ' B' ' 370' ' ' ALA . 2.8 mt-10 -45.31 -28.02 0.76 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.936 179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.53 ' ND2' ' HG3' ' B' ' 426' ' ' ARG . 0.6 OUTLIER -68.02 -34.12 75.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.333 179.4 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.836 ' HB3' HD22 ' B' ' 374' ' ' LEU . . . -65.24 -47.46 76.7 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.308 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.834 ' CA ' HD11 ' B' ' 438' ' ' LEU . 0.7 OUTLIER -88.28 20.23 3.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.565 179.667 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 8.4 ttt-85 -90.02 1.02 56.78 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.039 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.541 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 95.2 m-20 -114.69 76.09 0.97 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.67 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.449 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -39.33 -45.38 1.43 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 -179.716 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.449 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.2 mmpt? -63.36 -53.48 51.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.922 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.573 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -60.14 -37.36 79.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.122 0.487 . . . . 0.0 109.97 179.501 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.834 HD11 ' CA ' ' B' ' 432' ' ' LEU . 58.6 mt -66.53 -55.62 14.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.213 179.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -64.62 -25.9 68.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.821 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.517 ' CE2' ' CE1' ' B' ' 441' ' ' TYR . 0.2 OUTLIER -69.4 -41.47 76.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.17 0.51 . . . . 0.0 109.663 179.34 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.542 ' CD1' ' OH ' ' B' ' 380' ' ' TYR . 16.0 m-85 -71.99 -39.87 68.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.707 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -54.79 -40.05 69.06 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . 0.453 ' O ' ' HE3' ' B' ' 443' ' ' LYS . 0.1 OUTLIER -69.94 -53.91 15.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.501 179.067 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.526 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -53.55 -30.38 41.55 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.182 0.515 . . . . 0.0 110.004 179.653 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.57 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.681 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.446 " O5'" ' H8 ' ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.694 0 C5'-C4'-C3' 111.036 -2.976 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.872 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.179 0 O4'-C1'-N19 111.181 2.981 . 0.189 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.872 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.174 0 O4'-C1'-N19 111.084 2.884 . 0.241 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.553 " H5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.19 0 O4'-C1'-N19 111.317 3.117 . 0.259 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.616 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.928 0 O4'-C1'-N19 111.302 3.102 . 0.381 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.506 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.212 0 O4'-C1'-N19 111.251 3.051 . 0.096 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.861 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.847 0 C5'-C4'-C3' 111.013 -2.991 . 0.169 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.682 ' N4 ' ' N4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.235 0 O4'-C1'-N19 111.27 3.07 . 0.299 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.528 ' N6 ' ' O6 ' ' A' ' 25' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.299 0 O4'-C1'-N19 111.303 3.103 . 0.249 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.653 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.951 0 C5'-C4'-C3' 111.02 -2.987 . 0.113 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.635 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.331 0 O4'-C1'-N19 111.111 2.911 . 0.039 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.782 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.065 0 O4'-C1'-N19 111.268 3.068 . 0.084 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.782 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.155 0 O4'-C1'-N19 111.383 3.183 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.722 " H5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.429 -2.023 0 C5'-C4'-C3' 111.079 -2.948 . 0.059 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.536 ' C5 ' ' N4 ' ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.161 0 C5'-C4'-C3' 110.884 -3.077 . 0.129 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.582 " O4'" ' N6 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.711 0 O4'-C1'-N19 111.255 3.055 . 0.01 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.765 " O2'" ' P ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.888 0 O4'-C1'-N19 111.605 3.405 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.765 ' P ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 P--O5' 1.614 2.097 0 O4'-C1'-N19 111.183 2.983 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.466 " O4'" " O2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.299 0 O4'-C1'-N19 111.229 3.029 . 0.143 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.625 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.876 0 O4'-C1'-N19 111.275 3.075 . 0.0 OUTLIER '7D dist &a' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.688 ' H8 ' " O5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.766 0 O4'-C1'-N19 111.39 3.19 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.771 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.069 0 O4'-C1'-N19 111.162 2.962 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.756 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.281 0 O4'-C1'-N19 111.74 3.54 . 0.017 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.756 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.293 0 C5'-C4'-C3' 111.412 -2.725 . 0.091 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.614 ' C2 ' ' C5 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.681 0 C3'-C2'-C1' 105.049 3.943 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.791 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.178 0 O4'-C1'-N19 111.024 2.824 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.825 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.17 0 O4'-C1'-N19 111.159 2.959 . 0.201 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.825 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.358 0 C3'-C2'-C1' 104.202 3.002 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.792 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.258 0 O4'-C1'-N19 111.157 2.957 . 0.254 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.792 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.242 0 O4'-C1'-N19 111.598 3.398 . 0.156 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.659 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.655 0 O4'-C1'-N19 111.337 3.137 . 0.165 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.559 0 C5'-C4'-C3' 111.152 -2.899 . 0.072 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.224 0 N-CA-C 112.46 -0.256 . . . . 0.0 112.46 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 42.54 47.55 4.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.765 0.317 . . . . 0.0 110.862 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.484 HD23 ' HE2' ' B' ' 368' ' ' MET . 7.2 tp -128.37 116.36 19.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.375 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.507 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.3 OUTLIER -55.74 -61.91 2.05 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.187 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.484 ' HE2' HD23 ' B' ' 366' ' ' LEU . 3.0 ttp -32.49 -52.21 0.29 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.507 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 32.0 m-20 -58.65 -49.79 76.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.224 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.61 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -54.86 -79.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.275 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.479 ' HD2' ' HB2' ' B' ' 367' ' ' ASP . 0.2 OUTLIER -29.33 -45.15 0.04 OUTLIER 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.031 0.443 . . . . 0.0 111.016 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.573 ' CD ' ' N3 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -61.64 -61.64 2.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.323 179.551 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.668 ' HB3' HD22 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -40.93 -34.55 0.42 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.221 0.534 . . . . 0.0 110.137 179.309 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.648 ' N ' HD23 ' B' ' 374' ' ' LEU . 2.6 mt -68.29 -80.9 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.211 -179.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -85.88 27.79 0.85 Allowed 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -178.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.525 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 1.1 p -135.92 -31.57 0.92 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.241 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.762 ' O ' HD13 ' B' ' 378' ' ' ILE . 1.1 mm? -109.39 -27.85 9.26 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.762 HD13 ' O ' ' B' ' 377' ' ' LEU . 19.0 mm -129.5 -62.5 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.804 -179.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.847 ' HA2' HD12 ' B' ' 383' ' ' LEU . . . -32.64 102.72 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.732 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.529 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 10.1 p90 -115.04 177.73 4.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.888 0.375 . . . . 0.0 110.831 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' B' ' 382' ' ' SER . . . -65.99 118.14 9.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.213 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.464 ' HB3' ' O ' ' B' ' 381' ' ' ALA . 8.4 t 79.13 45.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.224 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.847 HD12 ' HA2' ' B' ' 379' ' ' GLY . 0.1 OUTLIER -95.39 -42.16 8.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.809 0.338 . . . . 0.0 110.706 179.675 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.513 ' CB ' ' O ' ' B' ' 383' ' ' LEU . 3.8 tpm_? 84.56 -6.16 0.99 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.106 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.921 ' HA ' HG12 ' B' ' 406' ' ' VAL . 4.5 tt -36.02 129.5 0.66 Allowed 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.778 0.323 . . . . 0.0 110.583 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.445 ' N ' HD23 ' B' ' 385' ' ' LEU . 3.9 p-80 -161.22 147.37 14.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.647 0.737 . . . . 0.0 112.862 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.494 ' OH ' ' HA ' ' B' ' 428' ' ' ALA . 11.9 m-85 -105.12 141.95 35.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.97 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -121.72 123.29 69.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.091 0.472 . . . . 0.0 111.289 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.15 130.41 38.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.629 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.669 HG23 ' CG2' ' B' ' 401' ' ' ILE . 28.0 m -141.36 144.9 25.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.964 0.411 . . . . 0.0 110.915 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.566 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 7.9 tptt 95.68 56.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.531 -179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.451 ' HA ' ' HD2' ' B' ' 393' ' ' PRO . 4.2 mmpt? -31.21 107.41 0.25 Allowed Pre-proline 0 N--CA 1.462 0.154 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.206 -179.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.489 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 4.3 Cg_exo -44.98 159.53 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.799 2.333 . . . . 0.0 113.353 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 16.6 p -128.12 158.27 38.46 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.972 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . 0.585 ' HB1' " H1'" ' A' ' 30' ' ' ' C' . . . -86.28 13.83 7.45 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.597 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 3.0 m -136.96 14.05 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.082 177.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.4 ' H ' ' HD3' ' B' ' 398' ' ' PRO . 0.4 OUTLIER 166.45 61.56 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 114.496 -1.229 . . . . 0.0 108.797 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.553 ' HB3' " C4'" ' A' ' 5' ' ' ' U' . 96.4 Cg_exo -42.8 -32.18 2.45 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.225 2.617 . . . . 0.0 113.086 -179.034 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.608 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.8 OUTLIER -30.67 127.21 0.15 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.022 -178.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 47.7 t -136.55 166.92 22.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.848 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.669 ' CG2' HG23 ' B' ' 390' ' ' VAL . 15.3 tt -122.51 161.98 22.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.105 0.478 . . . . 0.0 111.495 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.754 ' O ' HG22 ' B' ' 414' ' ' THR . 0.1 OUTLIER -128.68 143.76 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.943 -179.624 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -110.69 125.78 53.84 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.742 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 41.3 t -106.18 107.21 18.1 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.698 ' HB3' HG22 ' B' ' 411' ' ' VAL . 0.0 OUTLIER -147.65 -171.31 3.78 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.196 0.522 . . . . 0.0 111.536 -179.131 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.921 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.1 OUTLIER -135.85 147.5 28.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.157 -179.395 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . 0.456 ' HA3' ' HG2' ' B' ' 384' ' ' ARG . . . -35.34 -28.8 0.01 OUTLIER Glycine 0 C--N 1.332 0.311 0 CA-C-N 115.488 -0.778 . . . . 0.0 113.62 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . 0.463 ' N ' ' O ' ' B' ' 406' ' ' VAL . 59.3 m-20 -70.31 -3.17 15.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.877 0.37 . . . . 0.0 111.099 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 82.26 33.06 26.9 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.783 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.535 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 19.3 m -116.18 118.38 32.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.587 0.232 . . . . 0.0 111.375 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.698 HG22 ' HB3' ' B' ' 405' ' ' ARG . 70.9 t -92.32 111.9 25.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.156 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.535 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.5 OUTLIER -67.37 -36.21 80.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.364 -0.38 . . . . 0.0 109.978 179.164 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.45 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . -175.29 -152.57 9.45 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.518 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.754 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.1 OUTLIER -159.92 174.17 14.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.475 0.179 . . . . 0.0 110.701 -179.84 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.678 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -169.03 128.51 1.7 Allowed Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.133 -1.032 . . . . 0.0 112.877 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 7.1 p -123.49 155.59 29.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.853 0.358 . . . . 0.0 110.411 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.983 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -164.43 169.22 39.13 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.554 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -79.98 -39.95 29.0 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 117.312 0.556 . . . . 0.0 111.532 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.854 ' OD1' HD11 ' B' ' 422' ' ' ILE . 3.0 p-10 -101.99 31.75 3.77 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.763 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.79 -46.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.635 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -44.42 -55.17 5.23 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 118.796 0.725 . . . . 0.0 109.806 -179.474 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.983 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -42.83 -34.26 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.571 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.194 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.763 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -68.61 -44.81 73.48 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.184 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -60.03 -62.98 5.47 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.181 -1.009 . . . . 0.0 111.676 179.158 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.684 ' H ' HD12 ' B' ' 425' ' ' ILE . 4.4 mp -56.73 -42.24 76.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.91 0.386 . . . . 0.0 110.393 179.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.579 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -56.02 -43.57 77.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.126 179.434 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.591 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -56.41 -50.51 71.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.337 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.61 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -55.08 -59.65 4.46 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.665 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.468 ' O ' ' HB3' ' B' ' 433' ' ' ARG . 2.9 mt-10 -50.07 -29.87 9.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.124 0.488 . . . . 0.0 109.838 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.514 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 0.8 OUTLIER -67.79 -38.12 82.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.398 179.5 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.742 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -62.69 -41.79 99.29 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.165 0.507 . . . . 0.0 110.204 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.668 HD22 ' HB3' ' B' ' 373' ' ' GLN . 0.1 OUTLIER -87.26 5.94 35.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.362 179.124 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.514 ' CG ' ' O ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -89.4 11.81 18.14 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.109 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.569 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 14.4 m-20 -125.81 81.38 1.98 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.521 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 12.3 ptpt -46.93 -49.35 20.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.427 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.521 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.2 mmmm -61.22 -46.12 91.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.742 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.569 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 18.9 tmm? -63.24 -45.92 89.31 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.003 0.43 . . . . 0.0 110.076 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.504 HD22 HE22 ' B' ' 373' ' ' GLN . 84.3 mt -57.37 -62.42 1.78 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.915 179.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -54.03 -32.28 53.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.014 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.475 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.7 OUTLIER -57.86 -43.3 85.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.118 179.661 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -73.81 -28.31 61.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.568 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.57 -51.37 67.34 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 11.0 ttpp -63.31 -48.14 79.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.577 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.659 ' O ' HG23 ' B' ' 448' ' ' ILE . 3.6 mt-30 -50.11 -44.93 52.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.81 179.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.529 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -55.84 -47.07 77.9 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.361 179.506 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -61.96 -42.01 98.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.543 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.531 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -72.58 -78.0 0.09 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.963 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.659 HG23 ' O ' ' B' ' 444' ' ' GLN . 1.4 pt -0.39 103.9 0.02 OUTLIER Pre-proline 0 N--CA 1.467 0.389 0 O-C-N 124.066 0.854 . . . . 0.0 112.758 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . 0.528 ' CG ' ' OXT' ' B' ' 453' ' ' SER . 77.9 Cg_endo -83.83 71.62 5.72 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 123.036 2.491 . . . . 0.0 112.756 -179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' B' ' 449' ' ' PRO . 0.0 OUTLIER 50.94 30.56 5.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.625 179.683 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -176.57 -177.36 0.81 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.884 0.373 . . . . 0.0 111.085 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.13 -66.28 0.42 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.885 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . 0.528 ' OXT' ' CG ' ' B' ' 449' ' ' PRO . 57.9 p . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.898 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.8 HO2' ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.735 0 O4'-C1'-N19 111.427 3.227 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.8 ' H8 ' HO2' ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.082 0 O4'-C1'-N19 111.093 2.893 . 0.116 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.476 ' C5 ' ' C6 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.41 0 C5'-C4'-C3' 111.17 -2.886 . 0.13 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.536 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.171 0 O4'-C1'-N19 111.238 3.038 . 0.124 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.65 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.147 0 O4'-C1'-N19 111.103 2.903 . 0.167 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.5 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.288 0 C5'-C4'-C3' 111.317 -2.789 . 0.326 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.69 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.003 0 O4'-C1'-N19 111.541 3.341 . 0.276 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.465 ' C6 ' " H2'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.312 0 O4'-C1'-N19 110.941 2.741 . 0.237 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.439 2.045 0 O4'-C1'-N19 111.111 2.911 . 0.454 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.5 " O2'" " C5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -2.024 0 C5'-C4'-C3' 111.071 -2.953 . 0.199 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.6 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.517 0 C5'-C4'-C3' 111.211 -2.859 . 0.024 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.659 " O2'" " C5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.432 -1.757 0 C5'-C4'-C3' 110.862 -3.092 . 0.074 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.668 " O2'" " C5'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.444 0 C3'-C2'-C1' 104.833 3.704 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.692 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.282 0 C5'-C4'-C3' 110.893 -3.071 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.692 " O4'" " H2'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.935 0 C5'-C4'-C3' 111.002 -2.999 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.815 " H4'" " O5'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -1.996 0 O4'-C1'-N19 111.306 3.106 OUTLIER-EPSILON 0.01 1b . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.815 " O5'" " H4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.432 -1.766 0 C5'-C4'-C3' 110.999 -3.0 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.761 " H2'" " O4'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 P--O5' 1.61 1.658 0 O4'-C1'-N19 110.982 2.782 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.761 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.097 0 C5'-C4'-C3' 111.162 -2.892 . 0.044 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.832 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.434 1.673 0 C5'-C4'-C3' 110.982 -3.012 . 0.215 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.832 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.349 0 C5'-C4'-C3' 111.05 -2.967 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.805 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.9 0 C5'-C4'-C3' 111.175 -2.883 . 0.03 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.73 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.257 0 O4'-C1'-N19 111.218 3.018 . 0.051 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.622 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.298 0 O4'-C1'-N19 111.442 3.242 . 0.389 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.533 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.242 0 O4'-C1'-N19 110.982 2.782 . 0.18 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.533 ' C6 ' ' C6 ' ' A' ' 25' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.531 0 O4'-C1'-N19 111.122 2.922 . 0.119 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.474 " C5'" " O2'" ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.111 0 O4'-C1'-N19 111.235 3.035 . 0.131 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.581 " O2'" " O5'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.382 0 C3'-C2'-C1' 104.338 3.153 . 0.094 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.983 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.357 0 O4'-C1'-N19 111.294 3.094 . 0.174 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.983 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.161 0 O4'-C1'-N19 111.302 3.102 . 0.282 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.886 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.528 0 O4'-C1'-N19 111.288 3.088 . 0.303 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.576 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.261 0 C5'-C4'-C3' 111.158 -2.894 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . 0.404 ' O ' ' CG ' ' B' ' 429' ' ' GLU . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.527 -0.229 . . . . 0.0 112.527 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.81 51.04 1.94 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.842 0.353 . . . . 0.0 110.879 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.469 HD23 ' SD ' ' B' ' 368' ' ' MET . 0.6 OUTLIER -135.19 130.83 35.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.816 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.7 OUTLIER -53.83 -69.63 0.12 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.495 179.655 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.491 ' O ' ' HB2' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -40.76 -42.67 1.82 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.587 179.662 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -63.84 -36.92 85.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.521 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.645 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -68.54 -74.26 0.13 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.605 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.434 ' C ' ' O ' ' B' ' 370' ' ' ALA . 0.1 OUTLIER -37.11 -44.08 0.53 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.076 0.465 . . . . 0.0 110.274 179.67 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.554 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.6 OUTLIER -64.31 -42.65 96.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.764 179.695 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.651 ' NE2' HD22 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -57.34 -42.83 82.72 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.174 0.512 . . . . 0.0 110.563 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.569 ' CD2' HD12 ' B' ' 432' ' ' LEU . 0.4 OUTLIER -64.69 -72.79 0.14 Allowed 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -178.62 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 4.6 m-30 -79.54 -25.02 41.78 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -177.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -91.08 -31.71 16.15 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.872 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.941 ' O ' HD13 ' B' ' 378' ' ' ILE . 4.6 mm? -110.85 -13.63 14.11 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.711 -0.396 . . . . 0.0 112.056 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.941 HD13 ' O ' ' B' ' 377' ' ' LEU . 12.5 mm -141.99 -121.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.678 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.516 ' C ' ' O ' ' B' ' 378' ' ' ILE . . . -13.9 82.2 0.0 OUTLIER Glycine 0 C--N 1.343 0.971 0 N-CA-C 114.13 0.412 . . . . 0.0 114.13 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.669 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 0.6 OUTLIER -74.27 -58.97 2.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.764 0.316 . . . . 0.0 110.317 179.591 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.669 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 155.28 34.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.481 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.98 16.95 0.67 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.657 0.265 . . . . 0.0 111.188 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.929 HD13 ' HB2' ' B' ' 385' ' ' LEU . 0.2 OUTLIER -123.87 26.16 7.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.975 0.417 . . . . 0.0 110.635 179.565 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.474 ' HG3' ' HA3' ' B' ' 407' ' ' GLY . 0.0 OUTLIER 36.79 41.28 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.15 179.858 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.929 ' HB2' HD13 ' B' ' 383' ' ' LEU . 1.1 tt -69.2 132.62 46.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.978 0.418 . . . . 0.0 110.752 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 -169.05 135.25 1.7 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.298 0.57 . . . . 0.0 112.194 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.609 ' OH ' ' HB2' ' B' ' 431' ' ' ALA . 2.3 m-85 -84.41 178.55 7.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.325 -0.852 . . . . 0.0 108.741 178.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.656 HG23 ' O ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -153.6 108.57 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.297 0.57 . . . . 0.0 112.153 178.525 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.2 m -72.18 100.04 2.48 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.269 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.809 HG23 HG23 ' B' ' 401' ' ' ILE . 32.6 m -107.96 148.66 11.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.234 0.54 . . . . 0.0 111.116 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.464 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 15.1 tptt 80.82 55.97 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.406 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.443 ' C ' ' O ' ' B' ' 391' ' ' LYS . 3.0 mmpt? -33.88 131.33 0.4 Allowed Pre-proline 0 C--N 1.332 -0.152 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.555 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.537 ' HA ' ' O ' ' B' ' 398' ' ' PRO . 52.2 Cg_exo -53.74 174.42 0.15 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.554 2.169 . . . . 0.0 112.912 -178.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.527 ' OG1' ' N ' ' B' ' 397' ' ' ASP . 3.8 p -140.99 151.4 44.11 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.512 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -76.76 -5.37 47.86 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.137 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . 0.583 HG12 " O2'" ' A' ' 30' ' ' ' C' . 35.7 m -125.39 9.46 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.485 0.659 . . . . 0.0 110.073 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.527 ' N ' ' OG1' ' B' ' 394' ' ' THR . 7.5 m-20 179.18 63.19 0.11 Allowed Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 114.918 -1.037 . . . . 0.0 109.687 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.537 ' O ' ' HA ' ' B' ' 393' ' ' PRO . 39.7 Cg_exo -31.27 -65.99 0.08 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.333 2.689 . . . . 0.0 112.618 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.513 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 14.3 m120 7.71 116.6 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . 0.485 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 0.3 OUTLIER -134.14 149.74 51.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.577 178.503 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.809 HG23 HG23 ' B' ' 390' ' ' VAL . 1.3 tp -127.36 130.09 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 121.324 0.583 . . . . 0.0 112.478 -178.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.73 ' O ' HG22 ' B' ' 414' ' ' THR . 0.7 OUTLIER -91.47 161.44 2.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.182 179.501 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.656 ' O ' HG23 ' B' ' 388' ' ' VAL . 0.8 OUTLIER -138.58 96.83 3.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.97 0.414 . . . . 0.0 111.239 179.348 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -77.83 112.68 14.95 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.69 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.684 ' HD3' HG22 ' B' ' 411' ' ' VAL . 35.9 ttp180 -147.05 161.84 40.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.138 0.494 . . . . 0.0 111.551 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.681 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -130.56 128.8 63.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.149 -179.184 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . 0.474 ' HA3' ' HG3' ' B' ' 384' ' ' ARG . . . -30.03 -34.48 0.01 OUTLIER Glycine 0 C--N 1.334 0.442 0 C-N-CA 121.284 -0.484 . . . . 0.0 113.686 -179.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . 0.514 ' N ' ' O ' ' B' ' 406' ' ' VAL . 6.5 m-20 -55.19 -18.51 6.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.059 0.457 . . . . 0.0 110.386 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 99.35 32.35 5.81 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.834 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.571 ' HB ' HG23 ' B' ' 406' ' ' VAL . 40.0 m -122.19 121.38 36.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.964 0.412 . . . . 0.0 111.53 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.684 HG22 ' HD3' ' B' ' 405' ' ' ARG . 38.6 t -90.29 84.67 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.439 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.796 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -43.06 -23.32 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.34 -179.598 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.445 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 161.61 -174.01 38.07 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.013 -1.089 . . . . 0.0 113.044 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.73 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -143.08 171.73 13.67 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.714 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -160.7 144.06 9.58 Favored Glycine 0 C--O 1.221 -0.692 0 C-N-CA 119.779 -1.2 . . . . 0.0 113.16 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 5.0 p -132.86 155.01 40.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.513 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -170.3 151.65 17.03 Favored Glycine 0 N--CA 1.453 -0.187 0 C-N-CA 120.02 -1.086 . . . . 0.0 113.293 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.514 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 2.3 mtm-85 -70.51 -55.26 9.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.907 0.384 . . . . 0.0 110.499 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.879 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.2 OUTLIER -75.63 -21.65 57.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.888 179.217 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.879 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 98.14 -41.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.113 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.144 -179.291 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.596 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -52.95 -40.41 63.64 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 179.579 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.688 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -59.14 -35.92 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.748 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 177.355 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.644 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -68.73 -36.65 78.68 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.016 178.14 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.76 -67.14 2.15 Favored Glycine 0 C--N 1.334 0.427 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.952 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.41 ' O ' ' HB3' ' B' ' 428' ' ' ALA . 2.4 mp -53.81 -48.3 61.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.598 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -50.08 -49.57 51.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.178 179.402 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.539 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -49.68 -44.63 48.01 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.144 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.677 ' O ' HD13 ' B' ' 432' ' ' LEU . . . -57.35 -68.07 0.27 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.552 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.407 ' HA ' HD11 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -43.6 -25.6 0.18 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.668 179.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.445 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 11.3 m-80 -79.6 -32.88 41.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.712 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.609 ' HB2' ' OH ' ' B' ' 387' ' ' TYR . . . -65.52 -40.99 93.6 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 120.87 0.367 . . . . 0.0 110.517 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.902 ' O ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -95.85 25.86 4.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.479 0.657 . . . . 0.0 109.905 179.032 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 6.1 ttt180 -96.38 -8.83 31.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.087 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -101.16 96.68 7.37 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.788 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.523 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 4.4 ptpp? -51.78 -51.11 58.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.259 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.523 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 8.6 mmtt -56.25 -50.12 72.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.98 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.796 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -66.61 -43.49 84.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.93 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.902 HD11 ' O ' ' B' ' 432' ' ' LEU . 35.8 mt -61.72 -55.73 27.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.22 0.534 . . . . 0.0 111.103 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . 0.507 ' O ' ' HG3' ' B' ' 443' ' ' LYS . 20.2 t70 -65.39 -27.35 68.49 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.169 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -59.79 -47.43 85.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.949 -0.568 . . . . 0.0 109.994 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.626 ' HB2' HG23 ' B' ' 378' ' ' ILE . 60.8 m-85 -75.02 -35.43 61.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.592 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -48.57 -51.85 25.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.947 0.403 . . . . 0.0 110.075 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' B' ' 439' ' ' ASP . 0.0 OUTLIER -72.65 -46.93 51.47 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.873 179.035 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.603 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -53.69 -19.18 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.697 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.588 HH11 HD11 ' B' ' 448' ' ' ILE . 0.2 OUTLIER -87.52 -57.06 3.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.808 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -54.24 -22.25 11.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.122 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . -81.39 -59.47 2.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.11 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.603 HG23 ' O ' ' B' ' 444' ' ' GLN . 6.1 pt -39.01 133.03 1.12 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.259 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . 0.462 ' O ' ' O ' ' B' ' 448' ' ' ILE . 73.5 Cg_exo -50.06 -164.44 0.0 OUTLIER 'Trans proline' 0 C--O 1.231 0.136 0 C-N-CA 122.965 2.443 . . . . 0.0 112.515 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -100.84 -58.8 1.82 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.047 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 5.4 m -120.8 169.91 9.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.082 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -73.88 149.17 41.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.565 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 87.2 p . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.92 -179.679 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.809 HO2' ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.827 0 O4'-C1'-N19 111.438 3.238 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.843 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.071 0 O4'-C1'-N19 111.156 2.956 . 0.367 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.843 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.462 0 C5'-C4'-C3' 111.249 -2.834 . 0.13 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.539 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.252 0 O4'-C1'-N19 111.337 3.137 . 0.119 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.652 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 1.973 0 C5'-C4'-C3' 111.224 -2.85 . 0.028 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.503 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.346 0 C5'-C4'-C3' 111.18 -2.88 . 0.165 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.744 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 P--O5' 1.611 1.802 0 C5'-C4'-C3' 110.994 -3.004 . 0.133 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.699 ' N4 ' ' N4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.648 0 C3'-C2'-C1' 104.827 3.697 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.593 " O5'" " O2'" ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.1 0 O4'-C1'-N19 111.035 2.835 . 0.019 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.593 " O2'" " C5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.356 0 C5'-C4'-C3' 111.12 -2.92 . 0.057 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.649 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.359 0 O4'-C1'-N19 111.138 2.938 . 0.046 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.686 ' H6 ' " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.932 0 C5'-C4'-C3' 110.856 -3.096 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.721 " O2'" " H5'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.181 0 O4'-C1'-N19 111.515 3.315 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.721 " H5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.206 0 C5'-C4'-C3' 111.355 -2.763 . 0.452 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.651 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.906 0 C5'-C4'-C3' 110.806 -3.129 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.651 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.848 0 O4'-C1'-N19 111.61 3.41 . 0.28 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.561 " O2'" ' N9 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.776 0 C5'-C4'-C3' 110.942 -3.038 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.561 ' N9 ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.728 0 C5'-C4'-C3' 110.866 -3.09 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.514 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.095 0 C5'-C4'-C3' 111.083 -2.944 . 0.295 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.813 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 P--O5' 1.609 1.632 0 C5'-C4'-C3' 110.95 -3.033 . 0.179 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.813 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.443 0 C3'-C2'-C1' 104.447 3.275 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.843 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.612 1.916 0 O4'-C1'-N19 111.269 3.069 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.66 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.183 0 O4'-C1'-N19 111.815 3.615 . 0.026 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.631 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.236 0 O4'-C1'-N19 110.989 2.789 . 0.127 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.572 " H5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.273 0 O4'-C1'-N19 111.35 3.15 . 0.237 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.538 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.548 0 C5'-C4'-C3' 111.314 -2.791 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.597 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.161 0 O4'-C1'-N19 111.083 2.883 . 0.156 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.597 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.047 0 O4'-C1'-N19 111.408 3.208 . 0.434 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.794 " H2'" " O4'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.238 0 C5'-C4'-C3' 111.413 -2.725 . 0.075 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 1.017 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.21 0 O4'-C1'-N19 111.39 3.19 . 0.395 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 1.017 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.574 0 C3'-C2'-C1' 104.14 2.933 . 0.164 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.545 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.437 0 O4'-C1'-N19 111.134 2.934 . 0.341 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' B' ' 365' ' ' SER . . . . . . . . 0 N--CA 1.489 2.183 0 N-CA-C 112.59 -0.204 . . . . 0.0 112.59 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . 0.401 ' C ' ' O ' ' B' ' 364' ' ' GLY . 87.9 p 36.67 56.93 1.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.863 0.363 . . . . 0.0 111.213 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.738 HD23 ' SD ' ' B' ' 368' ' ' MET . 1.8 tp -132.42 126.6 33.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.864 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.9 OUTLIER -54.01 -68.77 0.15 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.888 0.375 . . . . 0.0 110.12 179.573 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.738 ' SD ' HD23 ' B' ' 366' ' ' LEU . 0.0 OUTLIER -34.59 -45.56 0.25 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.429 179.772 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' B' ' 366' ' ' LEU . 93.9 m-20 -59.39 -48.01 83.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.509 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 1.025 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -62.33 -75.28 0.08 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.581 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -31.58 -41.92 0.05 OUTLIER 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.105 -179.673 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.58 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.4 OUTLIER -65.44 -45.59 83.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.346 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.608 ' OE1' HD13 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -58.91 -39.58 81.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.177 0.513 . . . . 0.0 111.153 -179.792 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.48 HD11 ' OH ' ' B' ' 387' ' ' TYR . 1.3 mm? -67.66 -71.09 0.22 Allowed 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.505 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-30 -87.37 5.88 36.45 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -177.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.58 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -122.56 -20.35 6.04 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.103 179.321 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.772 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.8 OUTLIER -116.15 -27.42 6.9 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.453 179.75 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.772 HD13 ' O ' ' B' ' 377' ' ' LEU . 3.7 mm -142.07 33.58 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.112 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.505 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -122.28 86.27 0.39 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.72 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.535 ' CD2' ' HD3' ' B' ' 445' ' ' ARG . 5.1 p90 -97.86 167.63 10.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.726 0.298 . . . . 0.0 110.491 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.55 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -66.9 114.86 6.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.916 0.389 . . . . 0.0 111.714 -179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.55 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.4 p 90.42 44.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.881 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.507 ' CD1' ' O ' ' B' ' 378' ' ' ILE . 1.0 OUTLIER -92.61 -40.41 10.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.939 0.4 . . . . 0.0 110.684 179.657 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.446 ' CB ' ' O ' ' B' ' 383' ' ' LEU . 2.0 tpt180 81.78 -8.95 1.28 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.106 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.815 ' HA ' HG12 ' B' ' 406' ' ' VAL . 7.9 tt -40.83 136.02 1.53 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.493 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.523 ' N ' HD23 ' B' ' 385' ' ' LEU . 9.1 p-80 -164.11 148.85 10.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.541 0.686 . . . . 0.0 112.577 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.514 ' CD2' ' HB1' ' B' ' 427' ' ' ALA . 2.8 m-85 -101.23 141.95 33.37 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.989 179.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.666 HG23 ' HB2' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -121.25 120.02 60.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.16 0.505 . . . . 0.0 111.324 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 10.6 m -76.27 134.38 39.8 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.77 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.983 HG23 HG23 ' B' ' 401' ' ' ILE . 20.8 m -141.14 157.78 22.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.874 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.636 ' HB2' HG22 ' B' ' 401' ' ' ILE . 4.5 tmtt? 85.99 62.6 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.21 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.461 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER -29.47 125.92 0.26 Allowed Pre-proline 0 C--N 1.334 -0.075 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.001 -179.492 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.478 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 8.1 Cg_exo -70.39 161.16 47.02 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.559 2.173 . . . . 0.0 113.023 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.439 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 1.6 p -135.78 165.49 25.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.92 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . 0.472 ' O ' " O2'" ' A' ' 30' ' ' ' C' . . . -90.97 19.86 5.32 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.361 0.6 . . . . 0.0 110.478 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 14.5 m -139.78 14.19 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.329 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.478 ' H ' ' CD ' ' B' ' 398' ' ' PRO . 4.6 m-20 163.82 54.63 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.839 -179.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.515 ' HB3' " O4'" ' A' ' 5' ' ' ' U' . 5.2 Cg_exo -40.15 -25.56 0.17 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.509 2.806 . . . . 0.0 112.818 -179.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 52.5 p30 -30.99 148.41 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.328 0.585 . . . . 0.0 112.082 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -155.26 155.85 34.53 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.281 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.983 HG23 HG23 ' B' ' 390' ' ' VAL . 0.2 OUTLIER -108.49 152.8 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.448 179.707 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.702 HG23 ' HB1' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -123.48 142.69 39.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.736 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.666 ' HB2' HG23 ' B' ' 388' ' ' VAL . 1.8 mt-10 -108.29 128.4 54.71 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 179.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.545 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.8 OUTLIER -108.09 109.57 21.04 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.099 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.73 ' HB3' HG22 ' B' ' 411' ' ' VAL . 0.0 OUTLIER -145.59 -156.68 0.73 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.181 0.515 . . . . 0.0 111.704 -178.894 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.815 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -151.86 143.34 15.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.271 -179.443 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -38.23 -27.56 0.04 OUTLIER Glycine 0 C--N 1.332 0.353 0 CA-C-N 115.612 -0.722 . . . . 0.0 113.361 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . 0.575 ' OD1' HG23 ' B' ' 406' ' ' VAL . 47.0 p30 -69.51 -4.71 20.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.812 0.339 . . . . 0.0 110.878 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 85.04 39.33 8.61 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.156 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.564 ' HB ' HG23 ' B' ' 406' ' ' VAL . 12.8 m -127.31 118.29 23.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.724 0.297 . . . . 0.0 111.659 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.73 HG22 ' HB3' ' B' ' 405' ' ' ARG . 52.1 t -92.96 112.1 25.67 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.807 179.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.613 ' HG ' ' HE1' ' B' ' 437' ' ' MET . 0.5 OUTLIER -67.24 -37.64 83.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.383 179.418 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.49 ' O ' ' HB ' ' B' ' 414' ' ' THR . . . -174.35 -150.66 7.82 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.505 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.49 ' HB ' ' O ' ' B' ' 413' ' ' GLY . 13.2 t 176.09 155.3 0.21 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.694 0.283 . . . . 0.0 111.028 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.502 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -150.52 -177.18 24.2 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.461 -0.876 . . . . 0.0 112.796 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 2.2 p -153.16 161.55 2.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.796 0.331 . . . . 0.0 110.926 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.981 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -166.21 171.63 41.31 Favored Glycine 0 C--O 1.225 -0.454 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.933 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.443 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.0 OUTLIER -83.64 -39.92 19.64 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 117.067 0.434 . . . . 0.0 111.362 -179.857 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.85 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -104.44 31.81 4.43 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.048 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.56 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.33 -45.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 178.875 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.631 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -45.9 -49.35 15.67 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.296 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.981 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.49 -40.62 7.08 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.62 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.935 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.702 ' HB1' HG23 ' B' ' 402' ' ' VAL . . . -65.77 -40.42 91.99 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.485 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.92 -67.91 1.89 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.552 -0.832 . . . . 0.0 111.227 178.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.515 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 1.1 mp -52.52 -47.27 48.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.602 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 11.4 tpt180 -51.37 -47.95 62.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.72 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.622 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -47.36 -49.52 24.31 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.46 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 1.025 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -56.34 -57.66 11.31 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.657 ' HA ' HD21 ' B' ' 432' ' ' LEU . 0.5 OUTLIER -49.36 -20.05 0.61 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.712 179.257 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.504 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 4.3 m-80 -83.86 -36.91 23.08 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.916 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.4 ' HB3' HD21 ' B' ' 374' ' ' LEU . . . -65.42 -40.69 93.65 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.857 0.36 . . . . 0.0 111.167 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.8 HD13 ' O ' ' B' ' 428' ' ' ALA . 0.0 OUTLIER -89.57 9.41 26.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.98 179.89 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.528 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 23.8 ttm180 -89.97 3.74 52.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.077 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.456 ' HB3' ' CB ' ' B' ' 437' ' ' MET . 48.3 m-20 -115.09 87.34 2.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.896 0.379 . . . . 0.0 111.116 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.531 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -50.19 -51.23 45.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.987 179.506 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.531 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -57.94 -43.84 86.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.602 179.61 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.613 ' HE1' ' HG ' ' B' ' 412' ' ' LEU . 9.2 tmm? -66.48 -49.67 65.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.134 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.608 HD13 ' OE1' ' B' ' 373' ' ' GLN . 47.4 mt -54.91 -63.31 1.19 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.042 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -56.22 -31.1 63.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.938 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.3 OUTLIER -59.22 -38.95 81.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.105 179.723 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.436 ' O ' ' HB2' ' B' ' 445' ' ' ARG . 43.3 m-85 -82.62 -21.09 35.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.782 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -67.47 -52.48 38.77 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -61.69 -45.0 95.87 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.502 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 1.01 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.5 OUTLIER -59.63 -52.96 63.28 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.941 179.003 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.535 ' HD3' ' CD2' ' B' ' 380' ' ' TYR . 0.1 OUTLIER -40.47 -51.4 2.88 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.718 179.168 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -72.52 -31.58 65.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.15 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.514 ' O ' ' HD3' ' B' ' 449' ' ' PRO . . . -117.06 57.11 0.8 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.552 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 1.01 HG23 ' O ' ' B' ' 444' ' ' GLN . 17.3 pt -102.18 102.87 26.86 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-O 121.117 0.484 . . . . 0.0 111.243 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . 0.514 ' HD3' ' O ' ' B' ' 447' ' ' ALA . 31.7 Cg_exo -59.51 -146.55 0.01 OUTLIER 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 123.097 2.531 . . . . 0.0 112.603 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 27.1 ptt85 -54.76 -169.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.167 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -157.02 128.98 7.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.609 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -150.9 131.07 13.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.936 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 59.3 p . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.856 179.979 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 1.006 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.633 0 O4'-C1'-N19 111.207 3.007 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 1.006 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.229 0 O4'-C1'-N19 111.327 3.127 . 0.099 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.614 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.638 0 C3'-C2'-C1' 105.057 3.953 OUTLIER-DELTA 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.614 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.31 0 C5'-C4'-C3' 111.225 -2.85 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.584 " O2'" " H5'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.134 0 O4'-C1'-N19 111.155 2.955 . 0.122 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.584 " H5'" " O2'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.358 0 C5'-C4'-C3' 111.155 -2.897 . 0.162 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.583 " C5'" " O2'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.946 0 O4'-C1'-N19 111.331 3.131 . 0.042 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.49 " H2'" " O4'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 P--O5' 1.614 2.086 0 O4'-C1'-N19 110.888 2.688 . 0.111 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.724 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.486 0 C5'-C4'-C3' 111.278 -2.815 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.724 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.744 0 C3'-C2'-C1' 104.615 3.461 . 0.073 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.665 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 O4'-C1'-N19 111.096 2.896 . 0.038 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.702 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.797 0 C5'-C4'-C3' 111.048 -2.968 . 0.031 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.702 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 O4'-C1'-N19 111.433 3.233 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.661 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.114 0 O4'-C1'-N19 111.184 2.984 . 0.221 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.873 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.909 0 C5'-C4'-C3' 111.133 -2.912 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.873 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.609 1.624 0 O4'-C1'-N19 111.789 3.589 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.77 ' OP2' " H4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -1.966 0 C5'-C4'-C3' 110.677 -3.216 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.699 ' P ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.716 0 C5'-C4'-C3' 111.213 -2.858 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.604 " O2'" " C5'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 1.978 0 C5'-C4'-C3' 111.125 -2.917 . 0.05 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.822 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.865 0 C5'-C4'-C3' 111.004 -2.997 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.822 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.287 0 C5'-C4'-C3' 111.074 -2.951 . 0.047 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.865 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.867 0 O4'-C1'-N19 111.218 3.018 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.702 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.177 0 O4'-C1'-N19 111.076 2.876 . 0.019 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.66 ' C4 ' ' C6 ' ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.641 0 C3'-C2'-C1' 104.883 3.759 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.594 " C5'" HO2' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.271 0 O4'-C1'-N19 111.276 3.076 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.653 HO2' " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.508 0 O4'-C1'-N19 111.339 3.139 . 0.145 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.909 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.072 0 O4'-C1'-N19 111.027 2.827 . 0.104 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.909 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.591 1 C3'-C2'-C1' 105.199 4.11 OUTLIER-DELTA 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.929 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.021 0 O4'-C1'-N19 111.063 2.863 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.929 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.376 0 O4'-C1'-N19 111.65 3.45 . 0.343 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.667 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.772 0 C3'-C2'-C1' 104.335 3.15 . 0.076 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.638 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.588 0 C5'-C4'-C3' 111.129 -2.914 . 0.452 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.14 0 N-CA-C 112.543 -0.223 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 53.72 24.61 4.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.773 0.32 . . . . 0.0 111.047 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.856 HD22 ' ND2' ' B' ' 369' ' ' ASN . 0.2 OUTLIER -117.95 114.32 23.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.065 179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.589 ' OD1' HD12 ' B' ' 425' ' ' ILE . 7.3 t0 -56.57 -67.88 0.27 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.464 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.443 ' C ' ' O ' ' B' ' 367' ' ' ASP . 0.9 OUTLIER -33.49 -52.57 0.39 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.72 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.856 ' ND2' HD22 ' B' ' 366' ' ' LEU . 66.2 m-20 -60.0 -42.73 94.88 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.401 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.836 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -61.35 -78.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.796 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -32.03 -44.75 0.09 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.834 -179.606 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.506 ' O ' ' HB2' ' B' ' 376' ' ' SER . 0.0 OUTLIER -58.62 -58.93 6.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.355 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.922 ' OE1' HD23 ' B' ' 377' ' ' LEU . 0.0 OUTLIER -47.28 -56.13 7.37 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.331 0.586 . . . . 0.0 110.974 179.814 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.732 ' N ' HD23 ' B' ' 374' ' ' LEU . 2.0 mt -46.39 -69.76 0.12 Allowed 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -178.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -89.77 -45.16 9.48 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -176.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.506 ' HB2' ' O ' ' B' ' 372' ' ' ARG . 49.6 m -67.48 -20.78 65.51 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.753 -179.071 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.922 HD23 ' OE1' ' B' ' 373' ' ' GLN . 2.1 tp -110.82 -39.25 4.89 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 120.639 0.257 . . . . 0.0 110.836 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.615 HG22 ' H ' ' B' ' 379' ' ' GLY . 1.9 mm -126.91 -151.42 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.615 ' H ' HG22 ' B' ' 378' ' ' ILE . . . 40.81 64.85 1.14 Allowed Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.532 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.779 ' CE2' HG21 ' B' ' 448' ' ' ILE . 4.2 p90 -81.36 -61.74 1.86 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.558 0.179 . . . . 0.0 111.307 -179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.706 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 160.15 71.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 8.7 t 156.21 21.89 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.559 HD23 ' H ' ' B' ' 383' ' ' LEU . 0.8 OUTLIER -117.4 -26.39 6.7 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 122.063 -0.398 . . . . 0.0 110.949 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.497 ' HB3' ' O ' ' B' ' 383' ' ' LEU . 8.7 tpp180 79.59 48.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.552 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.74 HD23 ' N ' ' B' ' 386' ' ' HIS . 5.2 tt -84.25 132.57 34.63 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.74 ' N ' HD23 ' B' ' 385' ' ' LEU . 13.1 p-80 -164.94 147.8 8.36 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -179.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.463 ' CZ ' ' SG ' ' B' ' 404' ' ' CYS . 7.4 m-85 -103.26 144.92 30.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.133 178.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.611 HG23 ' HB2' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -123.97 125.17 70.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.167 0.508 . . . . 0.0 110.799 179.229 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.4 m -83.92 126.18 32.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.964 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.698 HG23 ' CG2' ' B' ' 401' ' ' ILE . 27.2 m -134.39 155.32 38.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.812 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.518 ' HB3' ' O ' ' B' ' 390' ' ' VAL . 11.6 tptp 86.82 57.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.599 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER -33.87 122.02 0.49 Allowed Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.515 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.438 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 17.1 Cg_exo -63.14 162.33 26.76 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.608 2.205 . . . . 0.0 112.701 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.9 p -134.49 170.14 16.21 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.888 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . 0.402 ' CB ' ' O2 ' ' A' ' 29' ' ' ' U' . . . -93.47 16.93 12.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.833 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 29.5 m -135.9 11.8 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.441 178.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.433 ' O ' ' N ' ' B' ' 399' ' ' ASN . 1.1 m-20 163.78 64.84 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.218 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.58 ' HB3' " C4'" ' A' ' 5' ' ' ' U' . 4.7 Cg_exo -37.05 -28.88 0.08 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 123.557 2.838 . . . . 0.0 112.363 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.497 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 8.3 m120 -21.91 121.88 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.483 -0.781 . . . . 0.0 112.347 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 5.9 t -143.22 154.5 43.91 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.795 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.698 ' CG2' HG23 ' B' ' 390' ' ' VAL . 16.8 tt -120.26 159.08 21.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.343 0.592 . . . . 0.0 111.381 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.847 ' O ' HG22 ' B' ' 414' ' ' THR . 0.2 OUTLIER -121.08 152.61 24.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.276 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.611 ' HB2' HG23 ' B' ' 388' ' ' VAL . 32.3 mt-10 -122.12 125.31 45.9 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.981 0.42 . . . . 0.0 110.107 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.624 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 48.3 t -110.4 111.84 23.38 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.582 ' HB3' HG22 ' B' ' 411' ' ' VAL . 15.3 ptp180 -145.85 -175.86 4.91 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.232 0.539 . . . . 0.0 111.651 -179.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.618 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -146.68 144.96 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.134 -179.388 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' B' ' 408' ' ' ASP . . . 66.54 6.24 34.03 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.265 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . 0.498 ' HB3' ' O ' ' B' ' 407' ' ' GLY . 59.8 t0 74.85 39.66 0.4 Allowed 'General case' 0 C--O 1.23 0.078 0 CA-C-O 120.639 0.257 . . . . 0.0 111.536 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -167.12 -50.66 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.303 -0.951 . . . . 0.0 113.054 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.618 ' HB ' HG23 ' B' ' 406' ' ' VAL . 17.6 m -72.97 94.98 1.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.598 0.237 . . . . 0.0 111.2 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.582 HG22 ' HB3' ' B' ' 405' ' ' ARG . 95.4 t -82.82 111.46 19.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.786 0.327 . . . . 0.0 111.294 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.558 HD22 ' HA ' ' B' ' 405' ' ' ARG . 0.7 OUTLIER -65.44 -32.84 74.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.368 179.149 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.404 ' HA3' ' OD1' ' B' ' 430' ' ' ASN . . . 178.55 -158.25 22.63 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.608 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.847 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -156.19 167.67 29.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.791 0.329 . . . . 0.0 111.146 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.667 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -159.42 124.59 1.37 Allowed Glycine 0 C--O 1.225 -0.464 0 C-N-CA 120.531 -0.843 . . . . 0.0 112.572 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.438 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 10.1 p -124.33 151.88 29.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.778 0.323 . . . . 0.0 110.842 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.946 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -167.03 159.49 32.89 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.212 -0.994 . . . . 0.0 113.284 -179.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.4 OUTLIER -67.18 -45.68 76.21 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.402 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.822 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -98.68 30.17 3.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.215 0.531 . . . . 0.0 109.586 179.078 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.63 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 50.41 -44.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 115.227 1.566 . . . . 0.0 115.227 178.319 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.621 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -47.43 -48.93 26.24 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.595 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.946 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.06 -37.23 3.84 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.628 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.169 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -69.02 -46.51 67.77 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.698 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.97 -59.34 10.95 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.429 -0.891 . . . . 0.0 111.424 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.784 ' N ' HD13 ' B' ' 425' ' ' ILE . 1.2 mm -60.93 -40.15 84.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.804 0.335 . . . . 0.0 110.806 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.585 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 25.2 tpt180 -57.41 -42.09 81.6 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.376 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.643 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -62.12 -45.26 94.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.394 179.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.836 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -56.16 -59.47 4.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.37 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.49 ' O ' ' HB2' ' B' ' 433' ' ' ARG . 1.0 OUTLIER -50.73 -31.46 16.71 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.127 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.501 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -63.86 -39.74 94.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.646 179.532 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.624 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -65.0 -41.62 95.21 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 120.993 0.425 . . . . 0.0 110.324 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.673 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.3 OUTLIER -86.24 9.12 18.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.592 179.353 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 2.3 ttm-85 -93.99 11.4 29.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.767 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.553 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 2.3 m-20 -125.39 79.81 1.84 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.805 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.505 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 10.4 ptpt -46.27 -48.9 17.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.016 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.505 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 3.3 mtpp -57.62 -46.62 83.9 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.817 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.553 ' HB3' ' HB2' ' B' ' 434' ' ' ASP . 1.5 tmm? -64.27 -65.12 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.049 0.452 . . . . 0.0 109.895 179.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.673 HD11 ' HA ' ' B' ' 432' ' ' LEU . 44.6 mt -39.13 -67.59 0.21 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.05 179.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -47.8 -43.95 28.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.69 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.464 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -52.64 -32.57 42.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.969 179.868 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.447 ' HB2' ' O ' ' B' ' 438' ' ' LEU . 25.7 m-85 -75.57 -41.33 55.0 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.756 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.426 ' O ' ' HB2' ' B' ' 445' ' ' ARG . . . -49.25 -43.9 43.26 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 178.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . 0.403 ' HD3' ' N ' ' B' ' 444' ' ' GLN . 0.1 OUTLIER -62.85 -50.45 70.86 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.769 178.512 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.53 ' O ' HG12 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -55.52 -36.57 66.87 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.775 179.064 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.617 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 5.0 mmm-85 -55.22 -52.9 61.89 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.489 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -58.4 -33.55 69.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.325 0.583 . . . . 0.0 109.465 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.466 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -84.18 -86.13 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.824 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.779 HG21 ' CE2' ' B' ' 380' ' ' TYR . 0.3 OUTLIER 27.14 89.01 0.07 OUTLIER Pre-proline 0 N--CA 1.465 0.279 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.516 -179.125 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -41.46 147.83 0.33 Allowed 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.876 2.384 . . . . 0.0 112.452 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -76.58 -29.2 56.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.396 -179.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 29.2 t -120.66 131.27 54.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 0.0 111.084 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -54.43 129.03 34.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.866 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 13.5 p . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.849 179.939 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.671 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 C2'--C1' 1.512 -1.565 0 C5'-C4'-C3' 111.088 -2.942 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.758 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.243 0 O4'-C1'-N19 111.114 2.914 . 0.039 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.758 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.517 0 C3'-C2'-C1' 104.839 3.711 . 0.044 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.628 " C5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.097 0 O4'-C1'-N19 111.372 3.172 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.492 ' C6 ' " H2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.362 0 O4'-C1'-N19 111.218 3.018 . 0.096 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.502 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.184 0 O4'-C1'-N19 111.128 2.928 . 0.194 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.873 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.876 0 O4'-C1'-N19 111.406 3.206 . 0.143 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.575 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.298 0 O4'-C1'-N19 111.088 2.888 . 0.228 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.575 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.508 0 C5'-C4'-C3' 111.257 -2.829 . 0.162 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.687 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.946 0 C5'-C4'-C3' 110.861 -3.093 . 0.093 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.606 " C5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.503 0 O4'-C1'-N19 110.977 2.777 . 0.033 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.934 ' H6 ' " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.818 0 C5'-C4'-C3' 111.037 -2.975 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.807 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.483 0 C3'-C2'-C1' 104.681 3.534 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.647 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.302 0 C5'-C4'-C3' 111.159 -2.894 . 0.149 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.787 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.251 0 C5'-C4'-C3' 111.099 -2.934 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.787 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.124 0 O4'-C1'-N19 111.551 3.351 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.703 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 P--O5' 1.611 1.821 0 C5'-C4'-C3' 110.839 -3.107 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.687 " H2'" " O4'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.436 1.835 0 C5'-C4'-C3' 111.023 -2.985 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.687 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.139 0 C5'-C4'-C3' 111.047 -2.968 . 0.04 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.72 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.723 0 C5'-C4'-C3' 110.898 -3.068 . 0.044 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.696 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.098 0 C5'-C4'-C3' 110.987 -3.009 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.844 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.962 0 O4'-C1'-N19 111.216 3.016 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.795 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.317 0 O4'-C1'-N19 111.762 3.562 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.689 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 P--O5' 1.616 2.261 0 O4'-C1'-N19 110.777 2.577 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.425 ' O6 ' ' O4 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.3 0 O4'-C1'-N19 111.295 3.095 . 0.327 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.649 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.328 0 O4'-C1'-N19 111.172 2.972 . 0.12 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.839 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.946 0 O4'-C1'-N19 111.141 2.941 . 0.257 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.839 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.414 0 C3'-C2'-C1' 104.514 3.349 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.916 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.273 0 O4'-C1'-N19 111.309 3.109 . 0.205 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.916 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.195 0 O4'-C1'-N19 111.613 3.413 . 0.166 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.804 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.268 0 O4'-C1'-N19 111.253 3.053 . 0.101 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.649 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.404 0 O4'-C1'-N19 111.101 2.901 . 0.501 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 N-CA-C 112.604 -0.198 . . . . 0.0 112.604 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . 0.475 ' HB2' ' OD1' ' B' ' 367' ' ' ASP . 0.3 OUTLIER 49.18 83.16 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.836 0.351 . . . . 0.0 110.622 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.45 ' HA ' HD12 ' B' ' 366' ' ' LEU . 7.0 tp -57.9 -18.31 22.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.456 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.694 ' HA ' HG23 ' B' ' 425' ' ' ILE . 0.4 OUTLIER -38.72 -68.89 0.14 Allowed 'General case' 0 C--O 1.237 0.447 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.36 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.482 ' CE ' ' ND2' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -32.91 -56.09 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.112 178.93 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.482 ' ND2' ' CE ' ' B' ' 368' ' ' MET . 2.7 m-20 -52.31 -56.1 17.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.376 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.991 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -43.4 -75.99 0.03 OUTLIER 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.591 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -35.78 -38.07 0.11 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.22 0.533 . . . . 0.0 110.36 179.849 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.545 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.1 tmt_? -59.6 -55.86 29.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.324 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.695 ' HB3' HD22 ' B' ' 432' ' ' LEU . 0.2 OUTLIER -50.4 -32.23 17.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.736 179.614 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.759 HD11 ' OH ' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -71.34 -78.41 0.08 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.714 -178.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.543 ' CD2' ' OP1' ' A' ' 20' ' ' ' A' . 3.5 m-30 -79.44 12.76 2.28 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -178.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -128.09 -28.46 2.62 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.705 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.993 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.4 OUTLIER -110.03 -16.9 13.71 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.758 -179.646 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.993 HD13 ' O ' ' B' ' 377' ' ' LEU . 13.9 mm -132.35 -60.02 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 121.005 0.431 . . . . 0.0 110.041 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.618 ' HA2' HD12 ' B' ' 383' ' ' LEU . . . -53.04 143.56 25.31 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.146 179.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.641 ' CE1' ' CZ ' ' B' ' 445' ' ' ARG . 0.5 OUTLIER -143.95 -48.94 0.29 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.557 -0.322 . . . . 0.0 111.537 179.82 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.526 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 171.76 -26.06 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.46 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.565 ' HB2' ' CE2' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -111.22 -6.51 14.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.808 0.337 . . . . 0.0 110.913 179.817 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.827 HD13 ' HB2' ' B' ' 385' ' ' LEU . 0.1 OUTLIER -48.18 -51.58 24.5 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.923 -179.968 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.484 ' HG2' ' HA3' ' B' ' 407' ' ' GLY . 2.3 tpt180 77.56 6.4 2.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.607 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.827 ' HB2' HD13 ' B' ' 383' ' ' LEU . 3.7 tt -49.54 135.28 18.51 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.793 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.417 ' O ' ' CD2' ' B' ' 386' ' ' HIS . 8.7 p-80 -153.35 134.46 14.06 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.365 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.759 ' OH ' HD11 ' B' ' 374' ' ' LEU . 6.9 m-85 -92.41 140.97 29.04 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.8 179.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -125.62 124.61 67.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.977 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 6.9 m -82.19 130.79 35.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.322 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 1.007 HG23 HG23 ' B' ' 401' ' ' ILE . 21.6 m -135.25 160.07 40.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.279 0.562 . . . . 0.0 110.983 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.653 ' CB ' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 73.85 53.7 0.11 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.533 -179.623 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.476 ' C ' ' O ' ' B' ' 391' ' ' LYS . 3.7 mmtp -25.52 136.29 0.08 OUTLIER Pre-proline 0 N--CA 1.464 0.269 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.425 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -68.55 160.73 48.09 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.26 1.973 . . . . 0.0 112.59 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 1.5 p -127.59 158.79 36.55 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.835 -179.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . 0.453 ' O ' " O2'" ' A' ' 30' ' ' ' C' . . . -87.05 14.71 7.0 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.266 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . 0.733 HG12 " H5'" ' A' ' 31' ' ' ' U' . 31.2 m -141.51 14.51 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.315 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 168.87 61.13 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 114.697 -1.138 . . . . 0.0 109.284 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.495 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 78.3 Cg_exo -41.8 -31.18 1.29 Allowed 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.329 2.686 . . . . 0.0 113.274 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.554 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.6 p-10 -28.39 119.32 0.12 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.803 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.51 150.41 52.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.578 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 1.007 HG23 HG23 ' B' ' 390' ' ' VAL . 0.2 OUTLIER -107.22 150.38 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.303 -179.897 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.721 ' CG2' ' HB1' ' B' ' 423' ' ' ALA . 0.1 OUTLIER -121.75 153.28 25.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.341 -179.818 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.446 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 7.3 mt-10 -123.69 132.77 53.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.856 0.36 . . . . 0.0 110.174 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.579 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -115.84 115.2 25.84 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.44 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.601 ' HB3' HG22 ' B' ' 411' ' ' VAL . 2.1 ptm180 -143.73 -164.19 1.82 Allowed 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.173 0.511 . . . . 0.0 111.486 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.667 HG12 ' CA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -145.44 144.31 21.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.288 -179.401 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . 0.484 ' HA3' ' HG2' ' B' ' 384' ' ' ARG . . . -36.21 -29.96 0.02 OUTLIER Glycine 0 C--N 1.331 0.298 0 CA-C-N 115.744 -0.662 . . . . 0.0 113.309 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' B' ' 406' ' ' VAL . 2.8 t70 -66.08 -8.23 22.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.77 0.319 . . . . 0.0 110.899 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 86.68 39.88 7.45 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.462 -179.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.514 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 53.1 m -129.05 116.44 19.3 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.601 HG22 ' HB3' ' B' ' 405' ' ' ARG . 48.1 t -86.19 110.95 20.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.887 178.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.993 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -64.49 -34.75 78.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.356 . . . . 0.0 110.304 179.742 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.449 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . -176.4 -154.9 12.24 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.677 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.467 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 12.9 t -173.78 168.99 4.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.693 0.283 . . . . 0.0 110.743 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.476 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -167.35 167.46 39.91 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.399 -0.905 . . . . 0.0 113.033 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.18 150.82 18.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 122.276 0.23 . . . . 0.0 110.388 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.855 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -160.26 143.5 9.1 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.322 -0.942 . . . . 0.0 112.927 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.495 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 15.1 ptt180 -56.16 -47.04 79.01 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.839 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.5 OUTLIER -99.75 34.38 2.28 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 178.884 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.723 HD12 ' C ' ' B' ' 420' ' ' ILE . 0.5 OUTLIER 46.35 -46.23 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 N-CA-C 115.506 1.669 . . . . 0.0 115.506 178.609 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.686 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -46.01 -48.17 16.7 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 -179.129 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.855 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -48.52 -40.12 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.719 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 178.109 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.721 ' HB1' ' CG2' ' B' ' 402' ' ' VAL . . . -63.51 -44.28 94.77 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.363 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.07 -65.22 3.23 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.484 -0.865 . . . . 0.0 111.456 178.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.694 HG23 ' HA ' ' B' ' 367' ' ' ASP . 4.4 mm -52.94 -35.85 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.059 0.456 . . . . 0.0 110.382 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.581 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 3.6 tpt180 -63.45 -49.12 74.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.531 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.525 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -51.71 -41.73 61.7 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.287 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.991 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -58.76 -62.22 2.03 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.31 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.524 ' HA ' HD11 ' B' ' 432' ' ' LEU . 0.3 OUTLIER -53.78 -20.44 5.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.244 179.295 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.469 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 1.9 m-80 -76.1 -40.05 53.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.812 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.423 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -64.62 -39.08 93.07 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.253 0.549 . . . . 0.0 109.579 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.916 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.2 OUTLIER -85.19 8.09 19.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.538 179.008 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.408 ' HB2' ' HA ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -87.85 -1.6 58.08 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.276 -179.759 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.552 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 6.3 m-20 -111.44 83.56 1.79 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.918 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.479 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 1.6 ptmm? -50.75 -49.4 58.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.006 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.479 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 4.2 mmtp -61.36 -45.1 95.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.166 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.993 ' SD ' HD12 ' B' ' 412' ' ' LEU . 2.0 ttp -67.63 -51.45 49.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.939 0.4 . . . . 0.0 110.488 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.916 HD11 ' HA ' ' B' ' 432' ' ' LEU . 80.6 mt -51.13 -62.62 1.5 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.213 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -50.99 -38.72 52.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.317 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.58 ' CZ ' ' OE1' ' B' ' 444' ' ' GLN . 0.9 OUTLIER -55.23 -36.8 66.39 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.7 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.665 ' CB ' HG23 ' B' ' 378' ' ' ILE . 32.1 m-85 -73.36 -46.04 51.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.163 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.416 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -41.88 -51.03 4.42 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -64.09 -42.18 97.03 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.58 ' OE1' ' CZ ' ' B' ' 440' ' ' PHE . 0.0 OUTLIER -53.59 -42.51 67.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.168 179.018 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.725 ' O ' HD11 ' B' ' 448' ' ' ILE . 40.2 mmt-85 -62.95 -38.73 92.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.624 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -67.59 -42.54 82.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.58 178.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.479 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -72.61 -82.43 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.353 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.725 HD11 ' O ' ' B' ' 445' ' ' ARG . 0.2 OUTLIER 26.82 96.9 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.291 -179.734 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -39.01 157.11 0.03 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.787 2.325 . . . . 0.0 112.689 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.19 -65.91 0.95 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.662 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.52 63.72 1.77 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.803 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -49.68 -44.01 47.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.09 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.261 -0.875 . . . . 0.0 110.946 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.812 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.436 1.814 0 O4'-C1'-N19 111.394 3.194 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.812 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.311 0 O4'-C1'-N19 111.184 2.984 . 0.083 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.642 " O2'" " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 C5'-C4'-C3' 111.074 -2.951 . 0.134 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.642 " C5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 P--O5' 1.613 1.987 0 O4'-C1'-N19 111.084 2.884 . 0.169 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.437 " C5'" ' HB3' ' B' ' 398' ' ' PRO . . . . . . . . 0 O4'--C4' 1.427 -2.143 0 C5'-C4'-C3' 111.06 -2.96 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.516 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.246 0 O4'-C1'-N19 111.481 3.281 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.787 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.056 0 O4'-C1'-N19 111.275 3.075 . 0.17 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.528 ' C4 ' ' N7 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.299 0 O4'-C1'-N19 111.106 2.906 . 0.331 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.528 ' N7 ' ' C4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.508 0 C5'-C4'-C3' 111.445 -2.703 . 0.128 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.443 ' C6 ' " H2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.04 0 O4'-C1'-N19 111.255 3.055 . 0.107 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.629 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.446 0 C5'-C4'-C3' 111.392 -2.739 . 0.07 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.796 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.876 0 O4'-C1'-N19 111.11 2.91 . 0.051 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.796 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.516 0 C3'-C2'-C1' 104.678 3.531 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.793 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.357 0 C5'-C4'-C3' 110.995 -3.004 . 0.052 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.869 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.428 -2.108 0 C5'-C4'-C3' 111.051 -2.966 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.869 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.226 0 O4'-C1'-N19 111.588 3.388 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.742 HO2' " C1'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.849 0 C5'-C4'-C3' 110.871 -3.086 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.742 " C1'" HO2' ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.953 0 C5'-C4'-C3' 111.128 -2.915 . 0.0 OUTLIER '7D dist 4n' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.622 ' H21' ' NZ ' ' B' ' 371' ' ' LYS . . . . . . . . 0 O4'--C1' 1.437 1.89 0 C5'-C4'-C3' 111.045 -2.97 . 0.395 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.811 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.845 0 C5'-C4'-C3' 110.881 -3.079 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.687 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.428 0 O4'-C1'-N19 111.226 3.026 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.878 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.978 0 O4'-C1'-N19 111.223 3.023 . 0.045 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.715 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.129 0 O4'-C1'-N19 111.866 3.666 . 0.051 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.819 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.199 0 C5'-C4'-C3' 111.293 -2.805 . 0.055 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.663 ' C2 ' ' C5 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.595 0 C3'-C2'-C1' 105.032 3.924 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.681 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.148 0 O4'-C1'-N19 111.126 2.926 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.817 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.072 0 O4'-C1'-N19 111.121 2.921 . 0.063 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.817 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.512 0 C3'-C2'-C1' 104.984 3.871 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.671 " H5'" " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.059 0 O4'-C1'-N19 111.199 2.999 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 1.005 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.318 0 O4'-C1'-N19 111.362 3.162 . 0.052 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 1.005 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.284 0 O4'-C1'-N19 111.508 3.308 . 0.206 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.324 0 O4'-C1'-N19 111.298 3.098 . 0.066 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.212 0 N-CA-C 112.558 -0.217 . . . . 0.0 112.558 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . 0.541 ' CB ' ' OP1' ' A' ' 15' ' ' ' A' . 24.9 p -102.7 31.79 3.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.794 0.331 . . . . 0.0 111.035 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 5.0 tp -60.4 -14.34 18.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.984 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.434 ' O ' ' HG2' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -41.59 -69.07 0.15 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.978 179.387 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.515 ' N ' ' HE3' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -36.09 -66.7 0.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.617 179.6 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -38.23 -48.87 1.33 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.5 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 1.118 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -60.38 -80.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.245 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.622 ' NZ ' ' H21' ' A' ' 19' ' ' ' G' . 0.0 OUTLIER -33.61 -40.44 0.07 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.99 0.424 . . . . 0.0 110.725 179.761 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.597 ' HG2' ' N3 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -57.13 -59.61 4.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.102 179.191 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.521 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -47.62 -49.46 27.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.171 0.51 . . . . 0.0 111.215 179.615 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.537 HD13 ' OH ' ' B' ' 387' ' ' TYR . 0.9 OUTLIER -52.28 -70.51 0.09 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.263 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.557 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.5 m-85 -80.72 -48.33 12.7 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -177.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.526 ' CB ' ' HD2' ' B' ' 372' ' ' ARG . 8.2 t -59.88 -26.45 65.88 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 -178.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.802 ' O ' HD13 ' B' ' 378' ' ' ILE . 4.4 mm? -120.63 -25.24 5.56 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -178.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.802 HD13 ' O ' ' B' ' 377' ' ' LEU . 3.1 mm -133.23 35.91 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.557 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -140.97 82.73 0.23 Allowed Glycine 0 C--N 1.33 0.215 0 C-N-CA 120.084 -1.055 . . . . 0.0 113.344 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.561 ' CD2' ' HD3' ' B' ' 445' ' ' ARG . 15.7 p90 -99.39 24.34 8.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.103 0.477 . . . . 0.0 109.872 178.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.532 ' HB3' ' O ' ' B' ' 380' ' ' TYR . . . 80.04 -89.46 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.497 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.442 ' C ' ' O ' ' B' ' 381' ' ' ALA . 55.6 m -33.2 -38.53 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.3 -179.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.574 HD22 HG11 ' B' ' 406' ' ' VAL . 0.7 OUTLIER -41.49 -39.7 1.6 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.9 0.381 . . . . 0.0 110.968 -179.612 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.06 35.87 2.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.42 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.771 ' HA ' HG12 ' B' ' 406' ' ' VAL . 8.9 tt -75.03 123.86 25.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.547 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -147.9 147.35 29.64 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.539 0.685 . . . . 0.0 112.194 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.579 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 4.4 m-85 -92.47 155.43 17.85 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.935 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.36 125.19 53.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 4.3 m -88.72 131.53 34.99 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.597 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 1.061 HG23 HG23 ' B' ' 401' ' ' ILE . 16.3 m -137.16 158.27 35.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.324 0.583 . . . . 0.0 111.454 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.791 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.1 OUTLIER 79.54 64.38 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.361 179.626 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.421 ' HA ' ' HD2' ' B' ' 393' ' ' PRO . 0.4 OUTLIER -39.46 103.79 0.3 Allowed Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.642 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.477 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 1.8 Cg_endo -45.99 165.52 0.07 OUTLIER 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.81 2.34 . . . . 0.0 112.961 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 3.1 p -124.38 162.27 24.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.671 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -85.4 12.44 8.32 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.509 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 20.3 m -141.5 10.0 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.249 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.533 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 0.2 OUTLIER -174.32 51.04 0.1 OUTLIER Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.465 -179.796 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.533 ' CD ' ' N ' ' B' ' 397' ' ' ASP . 95.4 Cg_exo -31.21 -29.52 0.02 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 124.164 3.242 . . . . 0.0 114.105 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.532 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.5 p-10 -37.06 129.38 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.822 0.344 . . . . 0.0 111.0 -179.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 28.4 t -143.94 158.56 43.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.237 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 1.061 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -116.25 144.55 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 CA-C-O 121.182 0.515 . . . . 0.0 111.771 -179.438 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.813 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.0 OUTLIER -127.11 128.67 70.71 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.603 179.951 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.503 ' CG ' ' OG1' ' B' ' 414' ' ' THR . 2.9 mt-10 -110.64 131.49 55.01 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.609 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.579 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 1.4 p -93.63 141.17 28.79 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 178.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.78 ' HA ' HD22 ' B' ' 412' ' ' LEU . 0.9 OUTLIER -162.16 -175.28 4.5 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.275 0.56 . . . . 0.0 112.345 -179.552 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.771 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -136.69 145.75 29.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.954 -179.622 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -34.89 -34.44 0.05 OUTLIER Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.654 -0.703 . . . . 0.0 113.742 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -60.82 -12.97 12.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.974 0.416 . . . . 0.0 110.726 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 91.03 36.3 6.75 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.722 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.554 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 18.5 m -118.65 116.46 26.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.538 0.209 . . . . 0.0 111.312 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.502 ' HA ' ' CB ' ' B' ' 405' ' ' ARG . 33.7 t -82.88 96.64 3.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.176 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.78 HD22 ' HA ' ' B' ' 405' ' ' ARG . 0.2 OUTLIER -50.89 -26.16 5.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.963 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.51 ' N ' ' SG ' ' B' ' 404' ' ' CYS . . . -177.44 -177.26 46.17 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 119.462 -1.351 . . . . 0.0 113.954 -179.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.791 ' CG2' HD11 ' B' ' 401' ' ' ILE . 6.3 m -148.56 120.08 7.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.28 -0.46 . . . . 0.0 110.469 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.585 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -130.48 163.77 23.11 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.419 -0.895 . . . . 0.0 113.152 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.467 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 3.2 p -135.33 161.06 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.763 -0.218 . . . . 0.0 110.416 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.819 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -155.87 115.61 0.67 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.043 -1.075 . . . . 0.0 113.424 -179.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.472 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -44.55 -54.82 5.67 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 122.189 0.196 . . . . 0.0 111.337 179.6 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.85 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.7 OUTLIER -86.98 -5.92 58.93 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.111 178.865 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.85 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.6 OUTLIER 94.46 -45.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 C-N-CA 123.65 0.78 . . . . 0.0 112.262 179.5 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -47.03 -60.56 2.37 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.616 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.819 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -42.26 -32.69 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.509 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.779 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -68.09 -45.95 72.34 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.146 179.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.509 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.54 -58.19 12.16 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 119.81 -1.186 . . . . 0.0 111.519 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.691 ' N ' HD13 ' B' ' 425' ' ' ILE . 1.9 mm -59.57 -36.28 64.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.768 0.318 . . . . 0.0 110.744 179.415 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.4 OUTLIER -62.15 -56.03 22.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.063 179.489 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.813 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -45.02 -42.3 8.24 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.017 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 1.118 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -53.62 -66.17 0.44 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.004 178.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.513 ' O ' ' N ' ' B' ' 433' ' ' ARG . 1.1 mt-10 -47.27 -44.37 22.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.687 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.441 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 0.7 OUTLIER -55.87 -29.49 60.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.909 179.685 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.452 ' HB3' HD22 ' B' ' 374' ' ' LEU . . . -72.3 -48.45 42.12 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 120.826 0.346 . . . . 0.0 110.421 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.847 ' H ' HD13 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -97.05 13.36 29.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.818 179.437 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -87.07 7.24 28.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.982 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.571 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 2.0 m-20 -117.65 74.65 0.94 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.918 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.435 ' C ' ' O ' ' B' ' 434' ' ' ASP . 14.3 ptmt -36.84 -43.85 0.46 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.499 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.432 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.1 OUTLIER -64.36 -47.92 77.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.397 179.768 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.629 ' SD ' HD12 ' B' ' 412' ' ' LEU . 2.0 ttp -60.79 -51.46 69.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.416 179.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.681 HD11 ' HB2' ' B' ' 432' ' ' LEU . 60.0 mt -58.0 -57.78 11.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.592 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -53.02 -30.42 35.28 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.914 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.466 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.6 OUTLIER -66.38 -40.85 89.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.501 179.191 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.572 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 42.9 m-85 -75.12 -49.49 19.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.812 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -41.48 -46.32 3.44 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -38.88 81.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.355 178.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.572 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -60.08 -26.78 66.44 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.119 179.122 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.566 ' O ' ' CG1' ' B' ' 448' ' ' ILE . 1.4 mmm180 -77.73 -45.89 23.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.563 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -55.76 -39.23 70.9 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.163 0.506 . . . . 0.0 109.793 179.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.513 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -73.97 -91.33 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.256 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.566 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 0.8 OUTLIER 18.04 91.73 0.04 OUTLIER Pre-proline 0 N--CA 1.466 0.328 0 O-C-N 123.735 0.647 . . . . 0.0 111.966 -179.679 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -40.3 -37.94 2.11 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 122.949 2.432 . . . . 0.0 112.681 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . 0.413 ' C ' ' OG ' ' B' ' 451' ' ' SER . 0.0 OUTLIER -41.73 141.23 0.83 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.915 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . 0.413 ' OG ' ' C ' ' B' ' 450' ' ' ARG . 0.0 OUTLIER 67.74 67.77 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.994 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -174.86 167.21 3.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.814 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.902 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.818 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.849 0 C3'-C2'-C1' 104.398 3.22 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.818 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.128 0 O4'-C1'-N19 111.13 2.93 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.499 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.791 0 C3'-C2'-C1' 104.88 3.756 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.542 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.268 0 O4'-C1'-N19 111.244 3.044 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.542 ' C6 ' " H2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.298 0 O4'-C1'-N19 111.259 3.059 . 0.326 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.637 " O2'" " H5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.178 0 C5'-C4'-C3' 111.116 -2.922 . 0.162 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.731 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.435 1.789 0 O4'-C1'-N19 111.444 3.244 . 0.23 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.468 " H2'" " O4'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.244 0 O4'-C1'-N19 111.138 2.938 . 0.132 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.468 " O4'" " H2'" ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.373 0 O4'-C1'-N19 111.19 2.99 . 0.07 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.5 " O2'" " O5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.575 0 O4'-C1'-N19 111.186 2.986 . 0.204 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.547 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.599 0 O4'-C1'-N19 110.983 2.783 . 0.047 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.751 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.938 0 O4'-C1'-N19 111.329 3.129 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.751 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.313 0 C3'-C2'-C1' 104.518 3.353 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.654 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.054 0 C5'-C4'-C3' 111.108 -2.928 . 0.034 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.93 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.422 0 C5'-C4'-C3' 111.035 -2.976 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.93 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.929 0 C5'-C4'-C3' 110.88 -3.08 . 0.157 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.448 " H2'" ' N9 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.201 0 C5'-C4'-C3' 110.925 -3.05 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.655 ' H61' " C2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.824 0 O4'-C1'-N19 111.012 2.812 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.514 " H2'" ' C8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.827 0 C5'-C4'-C3' 110.859 -3.094 . 0.099 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.649 " O2'" " C5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.9 0 C5'-C4'-C3' 110.709 -3.194 OUTLIER-DELTA 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.649 " C5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.613 2.026 0 O4'-C1'-N19 111.273 3.073 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.855 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.613 2.04 0 O4'-C1'-N19 111.318 3.118 . 0.019 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.788 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.258 0 O4'-C1'-N19 111.058 2.858 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.626 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.684 0 C3'-C2'-C1' 104.848 3.72 . 0.016 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.6 " O5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.443 2.434 0 O4'-C1'-N19 111.147 2.947 . 0.064 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.563 " O2'" " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.776 0 C5'-C4'-C3' 111.118 -2.922 . 0.092 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.757 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.145 0 O4'-C1'-N19 111.253 3.053 . 0.169 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.757 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.687 0 C3'-C2'-C1' 104.787 3.652 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.796 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.161 0 O4'-C1'-N19 111.315 3.115 . 0.111 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 1.021 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.353 0 O4'-C1'-N19 111.606 3.406 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 1.021 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.507 0 O4'-C1'-N19 111.277 3.077 . 0.178 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.515 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.373 0 O4'-C1'-N19 111.228 3.028 . 0.43 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.093 0 N-CA-C 112.342 -0.303 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 31.6 m 55.31 46.16 24.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.722 0.296 . . . . 0.0 110.836 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.444 ' HB3' ' HB2' ' B' ' 369' ' ' ASN . 0.3 OUTLIER -139.38 126.55 21.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.307 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.478 ' HB2' ' NZ ' ' B' ' 371' ' ' LYS . 0.6 OUTLIER -52.9 -68.03 0.2 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.667 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.503 ' HA ' ' CD ' ' B' ' 371' ' ' LYS . 4.2 tmm? -39.58 -46.36 1.76 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.666 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.444 ' HB2' ' HB3' ' B' ' 366' ' ' LEU . 0.9 OUTLIER -56.45 -52.75 63.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.411 179.756 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.895 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -50.9 -69.78 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.022 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.513 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 5.1 mttp -31.36 -53.71 0.23 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.124 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.535 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.7 ttt-85 -51.59 -45.92 63.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.553 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -57.14 -47.02 82.18 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.173 0.511 . . . . 0.0 110.737 179.491 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.608 ' N ' HD23 ' B' ' 374' ' ' LEU . 3.6 mt -53.91 -68.57 0.17 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -179.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.602 ' CE2' ' OP1' ' A' ' 20' ' ' ' A' . 3.6 m-30 -85.73 -42.21 14.44 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -177.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.7 OUTLIER -67.84 -27.94 67.13 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.218 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.684 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.3 OUTLIER -106.32 -31.34 8.66 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.773 0.32 . . . . 0.0 110.765 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.748 HG22 HD22 ' B' ' 383' ' ' LEU . 1.3 mm -137.24 -148.08 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.529 ' H ' HG22 ' B' ' 378' ' ' ILE . . . 28.73 72.83 0.04 OUTLIER Glycine 0 C--N 1.332 0.359 0 C-N-CA 121.23 -0.509 . . . . 0.0 113.45 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.637 ' CE1' HD13 ' B' ' 383' ' ' LEU . 10.4 p90 -89.93 -55.41 3.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.662 0.268 . . . . 0.0 111.116 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -176.69 -48.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.817 0.342 . . . . 0.0 111.366 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.48 16.65 4.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.124 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.748 HD22 HG22 ' B' ' 378' ' ' ILE . 2.9 tp -103.21 -27.77 12.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.028 0.442 . . . . 0.0 110.807 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 8.0 tpp85 62.32 15.71 7.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.971 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.681 ' HA ' HG12 ' B' ' 406' ' ' VAL . 6.5 tt -48.02 128.74 14.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.702 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.552 ' O ' ' CD2' ' B' ' 386' ' ' HIS . 0.6 OUTLIER -158.59 136.95 10.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.304 0.573 . . . . 0.0 112.25 -179.639 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.582 ' CZ ' ' HB3' ' B' ' 404' ' ' CYS . 6.9 m-85 -87.86 162.93 16.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.578 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.591 HG23 ' O ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -138.35 147.58 25.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.97 178.498 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . 0.446 HG22 ' O ' ' B' ' 389' ' ' THR . 1.0 OUTLIER -112.12 109.94 19.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 0.0 110.668 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.956 HG23 HG23 ' B' ' 401' ' ' ILE . 29.7 m -112.51 155.13 13.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.559 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.634 ' HB3' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 67.68 69.38 0.35 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.413 -179.665 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.424 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 17.0 mmtt -54.56 149.27 21.88 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.097 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.539 ' HB2' " O2'" ' A' ' 5' ' ' ' U' . 11.2 Cg_exo -72.55 165.06 33.8 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 123.081 2.521 . . . . 0.0 112.526 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.471 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 1.2 p -156.47 165.84 35.14 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.498 179.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -79.37 4.78 14.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.846 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . 0.582 HG23 ' OD2' ' B' ' 397' ' ' ASP . 6.1 m -130.99 17.06 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.292 0.568 . . . . 0.0 109.558 178.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.582 ' OD2' HG23 ' B' ' 396' ' ' VAL . 2.8 p30 166.02 60.42 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.967 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.511 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 96.3 Cg_exo -39.4 -54.72 1.76 Allowed 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.045 2.497 . . . . 0.0 112.934 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.494 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.8 OUTLIER -21.65 137.01 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.402 -178.558 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -143.69 141.53 30.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.973 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.956 HG23 HG23 ' B' ' 390' ' ' VAL . 0.1 OUTLIER -111.16 139.0 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 CA-C-O 121.465 0.65 . . . . 0.0 111.776 -179.055 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.781 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -102.27 176.65 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.055 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.591 ' O ' HG23 ' B' ' 388' ' ' VAL . 4.9 mt-10 -156.2 106.98 2.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.984 0.421 . . . . 0.0 110.833 179.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.582 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -88.64 128.45 35.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.482 ' HA ' ' O ' ' B' ' 410' ' ' THR . 12.5 ptt180 -155.19 173.09 17.11 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.642 -179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.681 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -132.81 132.59 59.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.87 -179.249 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' B' ' 406' ' ' VAL . . . -30.95 -32.14 0.01 OUTLIER Glycine 0 C--N 1.333 0.407 0 O-C-N 123.436 0.46 . . . . 0.0 113.555 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . 0.545 ' N ' ' O ' ' B' ' 406' ' ' VAL . 21.4 t0 -57.17 -16.42 7.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.014 0.435 . . . . 0.0 110.387 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' B' ' 406' ' ' VAL . . . 95.72 35.86 5.49 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.785 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.482 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 16.9 m -128.28 124.79 37.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.082 0.468 . . . . 0.0 111.737 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.489 HG13 ' O ' ' B' ' 404' ' ' CYS . 47.9 t -89.2 89.43 3.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.525 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.643 HD12 ' CE ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -46.01 -26.44 0.73 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.897 0.38 . . . . 0.0 110.23 -179.928 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.46 ' O ' HG12 ' B' ' 411' ' ' VAL . . . 177.61 -173.77 46.37 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.858 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.467 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 3.4 t -160.64 171.37 19.03 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.667 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -173.01 170.41 43.56 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 118.525 -1.798 . . . . 0.0 114.836 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.526 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 5.2 p -136.76 152.05 28.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.321 -0.439 . . . . 0.0 110.209 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.809 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -153.66 111.54 0.49 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.904 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -42.05 -56.77 2.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.739 0.304 . . . . 0.0 110.923 179.706 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.893 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.1 OUTLIER -82.7 -11.27 58.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.248 179.151 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.893 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 97.12 -44.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.519 -0.249 0 C-N-CA 123.873 0.869 . . . . 0.0 111.903 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.526 ' HE3' " O3'" ' A' ' 22' ' ' ' C' . 0.5 OUTLIER -48.08 -59.31 3.48 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 179.534 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.809 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -41.86 -31.42 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 177.845 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.793 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -71.65 -45.33 62.34 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.687 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.11 -59.9 9.27 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 119.906 -1.14 . . . . 0.0 111.702 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.736 ' N ' HD13 ' B' ' 425' ' ' ILE . 1.2 mm -57.84 -51.23 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.89 0.376 . . . . 0.0 110.797 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.567 ' HG2' ' HA3' ' B' ' 415' ' ' GLY . 0.0 OUTLIER -46.37 -51.17 15.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.237 179.687 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.588 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -51.1 -54.15 27.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.807 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.895 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -51.94 -65.5 0.55 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.253 0.549 . . . . 0.0 110.639 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.664 ' HA ' HD21 ' B' ' 432' ' ' LEU . 55.9 mt-10 -52.87 -19.52 2.61 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.443 179.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.485 ' ND2' ' HG3' ' B' ' 426' ' ' ARG . 0.8 OUTLIER -77.97 -32.47 51.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.34 -179.795 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.3 -42.53 44.96 Favored 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.345 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.964 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -87.33 14.48 7.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.759 179.807 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.495 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 8.2 ttt85 -88.01 4.65 44.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.67 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.564 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 12.7 m-20 -116.07 72.37 0.81 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.074 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' B' ' 436' ' ' LYS . 15.2 ptpt -41.69 -47.33 3.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.686 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.518 ' N ' ' HG3' ' B' ' 435' ' ' LYS . 1.7 mmmm -58.4 -47.63 83.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.146 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.643 ' CE ' HD12 ' B' ' 412' ' ' LEU . 13.2 tmm? -65.79 -54.7 23.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.012 0.434 . . . . 0.0 109.864 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.964 HD11 ' HA ' ' B' ' 432' ' ' LEU . 99.2 mt -51.61 -68.07 0.2 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.221 179.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -44.41 -36.2 2.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.859 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.633 ' CE2' ' CE1' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -60.98 -41.91 97.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.26 0.552 . . . . 0.0 109.639 179.692 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.633 ' CE1' ' CE2' ' B' ' 440' ' ' PHE . 40.9 m-85 -75.54 -33.7 60.7 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.545 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.81 -46.1 64.14 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.93 -45.62 77.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.479 178.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.886 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -57.99 -25.92 61.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.306 179.376 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.577 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -88.9 -24.38 22.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.434 -179.283 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -80.64 -41.16 24.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.929 0.395 . . . . 0.0 110.471 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.437 ' O ' ' N ' ' B' ' 449' ' ' PRO . . . -68.94 -50.55 48.33 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.188 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.886 HG23 ' O ' ' B' ' 444' ' ' GLN . 3.8 pt -30.53 92.92 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.874 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . 0.437 ' N ' ' O ' ' B' ' 447' ' ' ALA . 72.5 Cg_exo -48.08 -37.28 30.16 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.798 2.332 . . . . 0.0 111.881 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 50.46 -159.38 0.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.973 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 52.12 89.68 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.944 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -98.46 -49.9 4.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.86 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 8.5 t . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.921 179.967 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.792 HO2' ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.419 -2.846 0 C3'-C2'-C1' 104.458 3.287 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.792 ' H8 ' HO2' ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 1.959 0 O4'-C1'-N19 111.294 3.094 . 0.03 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.712 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.357 0 O4'-C1'-N19 111.017 2.817 . 0.244 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.492 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.206 0 C5'-C4'-C3' 111.227 -2.849 . 0.036 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.515 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.104 0 O4'-C1'-N19 111.462 3.262 . 0.254 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.499 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.281 0 O4'-C1'-N19 111.168 2.968 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.793 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.98 0 O4'-C1'-N19 111.291 3.091 . 0.154 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.682 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.195 0 O4'-C1'-N19 111.12 2.92 . 0.235 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.682 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.31 0 O4'-C1'-N19 110.986 2.786 . 0.1 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.85 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.873 0 C5'-C4'-C3' 111.045 -2.97 . 0.094 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.64 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.464 0 O4'-C1'-N19 111.343 3.143 . 0.061 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.717 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.942 0 C5'-C4'-C3' 111.111 -2.926 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.717 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.345 0 C3'-C2'-C1' 104.468 3.298 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.765 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.284 0 C5'-C4'-C3' 111.111 -2.926 . 0.247 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.872 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.435 1.78 0 C5'-C4'-C3' 110.898 -3.068 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.872 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.381 0 O4'-C1'-N19 111.418 3.218 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.687 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.143 0 O4'-C1'-N19 111.255 3.055 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.747 " O5'" ' H8 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.727 0 C5'-C4'-C3' 110.888 -3.075 OUTLIER-DELTA 0.0 OUTLIER '7D dist 2a' 0.0 . . . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.622 ' H21' ' CE ' ' B' ' 371' ' ' LYS . . . . . . . . 0 O4'--C1' 1.439 2.091 0 O4'-C1'-N19 111.162 2.962 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.916 " H2'" " O4'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.434 1.693 0 C5'-C4'-C3' 110.984 -3.011 . 0.219 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.916 " O4'" " H2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.386 0 C3'-C2'-C1' 104.448 3.276 . 0.029 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.849 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.873 0 O4'-C1'-N19 111.217 3.017 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.632 " O2'" " C5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.172 0 O4'-C1'-N19 111.77 3.57 . 0.029 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.87 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.181 0 C5'-C4'-C3' 111.43 -2.713 . 0.056 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.506 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.288 0 O4'-C1'-N19 111.23 3.03 . 0.562 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.606 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.518 0 C5'-C4'-C3' 111.19 -2.873 . 0.078 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.79 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.036 0 O4'-C1'-N19 111.153 2.953 . 0.159 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.79 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.614 0 C3'-C2'-C1' 104.955 3.839 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.711 ' H6 ' " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.194 0 O4'-C1'-N19 111.319 3.119 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 1.001 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.327 0 O4'-C1'-N19 111.628 3.428 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 1.001 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.787 0 C3'-C2'-C1' 104.566 3.406 . 0.059 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.556 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.419 -2.862 0 C3'-C2'-C1' 104.21 3.011 . 0.297 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.636 -0.186 . . . . 0.0 112.636 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . 0.481 ' O ' ' HB2' ' B' ' 366' ' ' LEU . 1.6 t -88.09 17.13 5.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.977 0.418 . . . . 0.0 110.708 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.495 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 0.1 OUTLIER 83.49 -35.15 0.07 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.738 179.709 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.472 ' OD1' ' N ' ' B' ' 367' ' ' ASP . 0.5 OUTLIER -42.91 -78.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.774 0.321 . . . . 0.0 110.4 179.867 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.603 ' CE ' ' ND2' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -37.49 -44.75 0.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.54 -179.846 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.603 ' ND2' ' CE ' ' B' ' 368' ' ' MET . 5.2 m-20 -52.1 -57.97 7.96 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.057 0.456 . . . . 0.0 110.337 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.941 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -57.66 -72.51 0.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.622 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.622 ' CE ' ' H21' ' A' ' 19' ' ' ' G' . 0.0 OUTLIER -36.04 -31.92 0.03 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.977 0.418 . . . . 0.0 110.21 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.631 ' CG ' ' N3 ' ' A' ' 18' ' ' ' A' . 0.1 OUTLIER -65.42 -54.02 34.7 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.56 178.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.709 ' HG2' HD22 ' B' ' 377' ' ' LEU . 0.0 OUTLIER -53.73 -37.89 63.8 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.367 0.603 . . . . 0.0 110.328 179.017 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.543 ' N ' HD23 ' B' ' 374' ' ' LEU . 2.9 mt -64.56 -79.37 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -178.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.407 ' CD2' " H5'" ' A' ' 20' ' ' ' A' . 3.4 m-30 -85.47 12.42 8.49 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.581 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -127.2 -15.38 5.24 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.686 -0.406 . . . . 0.0 111.741 179.805 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 1.053 ' O ' HD13 ' B' ' 378' ' ' ILE . 9.0 mp -124.98 -21.77 4.62 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.808 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 1.053 HD13 ' O ' ' B' ' 377' ' ' LEU . 12.1 mm -137.41 -72.39 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.619 ' HA2' HD13 ' B' ' 383' ' ' LEU . . . -47.14 79.45 0.0 OUTLIER Glycine 0 CA--C 1.52 0.37 0 CA-C-N 116.201 -0.454 . . . . 0.0 113.807 -179.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.591 ' CD2' HD12 ' B' ' 383' ' ' LEU . 45.3 p90 -76.9 -161.07 0.18 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.649 0.261 . . . . 0.0 111.058 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.553 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -84.7 105.73 15.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.693 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.553 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.1 t 91.22 47.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.719 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.78 HD23 ' O ' ' B' ' 383' ' ' LEU . 4.5 tt -101.93 -23.21 14.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.889 0.376 . . . . 0.0 110.276 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.493 ' O ' ' ND1' ' B' ' 386' ' ' HIS . 13.7 tpt180 81.28 5.0 1.4 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.354 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.603 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 6.1 tt -57.13 135.23 56.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.945 0.403 . . . . 0.0 110.376 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.529 ' N ' HD23 ' B' ' 385' ' ' LEU . 18.3 p-80 -167.05 147.41 5.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.405 0.621 . . . . 0.0 112.375 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.531 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 4.1 m-85 -98.85 138.66 35.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.385 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.515 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -118.01 118.77 59.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.298 0.57 . . . . 0.0 110.629 179.272 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 53.9 m -78.64 129.19 34.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.982 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 1.003 HG23 HG23 ' B' ' 401' ' ' ILE . 27.3 m -136.71 154.29 31.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.666 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.707 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 84.88 49.27 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.354 -179.539 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.444 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER -29.76 109.44 0.25 Allowed Pre-proline 0 N--CA 1.462 0.144 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.33 -179.433 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.459 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 1.9 Cg_endo -48.01 158.54 0.84 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 122.816 2.344 . . . . 0.0 113.422 -179.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.509 ' HG1' ' CG ' ' B' ' 397' ' ' ASP . 40.2 p -124.69 165.01 18.69 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.729 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . 0.556 ' HB1' " H1'" ' A' ' 30' ' ' ' C' . . . -88.63 15.8 7.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.802 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . 0.574 ' CG2' ' O ' ' B' ' 396' ' ' VAL . 0.2 OUTLIER -141.6 9.56 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.937 0.875 . . . . 0.0 109.909 179.51 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.509 ' CG ' ' HG1' ' B' ' 394' ' ' THR . 3.5 p-10 171.22 59.12 0.02 OUTLIER Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.543 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.481 ' O ' ' C ' ' B' ' 399' ' ' ASN . 5.2 Cg_exo -39.34 -31.55 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 123.611 2.874 . . . . 0.0 112.412 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.511 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 13.9 m120 -25.38 109.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.568 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . 0.409 ' O ' HG23 ' B' ' 416' ' ' VAL . 12.9 m -127.92 162.53 26.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.605 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 1.003 HG23 HG23 ' B' ' 390' ' ' VAL . 0.6 OUTLIER -119.78 151.01 22.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.517 -179.882 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.726 ' CG2' ' HB1' ' B' ' 423' ' ' ALA . 0.1 OUTLIER -120.27 154.3 23.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.515 ' CB ' HG23 ' B' ' 388' ' ' VAL . 13.6 mm-40 -122.81 130.15 52.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.809 0.338 . . . . 0.0 110.685 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.532 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.5 OUTLIER -112.43 112.67 24.39 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.842 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.52 ' CG ' ' N ' ' B' ' 406' ' ' VAL . 0.1 OUTLIER -138.64 -166.33 1.99 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 121.349 0.595 . . . . 0.0 111.888 -178.823 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.753 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -157.79 140.4 6.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.328 -179.354 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . 0.46 ' HA2' ' HG2' ' B' ' 384' ' ' ARG . . . 64.78 6.73 25.24 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.551 -0.833 . . . . 0.0 111.322 -178.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 20.6 t70 72.41 35.45 1.17 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.685 0.279 . . . . 0.0 111.11 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -155.73 -49.46 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.497 -0.858 . . . . 0.0 113.22 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.753 ' HB ' HG23 ' B' ' 406' ' ' VAL . 53.4 m -82.12 105.65 13.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.681 0.277 . . . . 0.0 111.68 -179.4 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.408 ' CG1' ' OE1' ' B' ' 403' ' ' GLU . 79.1 t -90.06 111.07 22.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.651 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.889 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -64.65 -35.23 80.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.313 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.462 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 175.76 -148.68 9.5 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.561 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.501 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 8.7 t -168.53 166.84 11.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.776 0.322 . . . . 0.0 111.301 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.576 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -154.8 136.87 5.38 Favored Glycine 0 C--O 1.228 -0.259 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.679 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.535 ' HB ' HD12 ' B' ' 401' ' ' ILE . 8.4 p -122.69 149.19 26.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.893 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -163.63 151.88 21.57 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.135 -1.031 . . . . 0.0 113.24 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.481 ' HG3' ' OD1' ' B' ' 419' ' ' ASN . 0.6 OUTLIER -62.83 -45.45 92.56 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.359 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.842 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.5 OUTLIER -100.02 32.19 3.03 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.892 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.668 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 47.42 -44.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 178.499 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.623 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -47.88 -45.46 30.45 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 119.12 0.873 . . . . 0.0 108.93 -179.219 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.893 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -49.95 -40.55 16.68 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.785 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 177.873 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.726 ' HB1' ' CG2' ' B' ' 402' ' ' VAL . . . -62.2 -46.04 90.66 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.492 178.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.49 -70.03 1.13 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.404 -0.903 . . . . 0.0 111.604 178.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.471 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 0.5 OUTLIER -50.92 -33.47 12.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.315 179.284 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.586 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 1.5 tpt180 -63.76 -57.89 8.56 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.513 179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.616 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -42.97 -39.59 2.66 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.941 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -60.29 -60.46 3.78 Favored 'General case' 0 C--O 1.239 0.508 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.542 ' O ' HD22 ' B' ' 432' ' ' LEU . 32.2 mt-10 -47.66 -21.28 0.35 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.281 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.501 ' ND2' ' O ' ' B' ' 414' ' ' THR . 1.7 m-80 -81.57 -36.48 29.01 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.741 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.455 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -63.62 -38.38 90.91 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.161 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.685 HD13 ' O ' ' B' ' 428' ' ' ALA . 0.0 OUTLIER -94.08 11.68 29.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.991 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 0.9 OUTLIER -92.8 4.62 53.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.142 -179.79 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.544 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 15.6 m-20 -119.31 92.14 3.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 0.0 110.85 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.438 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -56.38 -46.43 80.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.476 -179.635 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.438 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -60.61 -42.14 96.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.943 0.401 . . . . 0.0 110.548 -179.8 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.889 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -71.37 -46.49 60.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.164 179.442 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.55 HD11 ' HA ' ' B' ' 432' ' ' LEU . 54.5 mt -56.12 -65.41 0.61 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.115 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -51.16 -36.48 41.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.97 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.466 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.9 OUTLIER -53.55 -44.42 69.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.67 179.642 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.788 ' CB ' HG23 ' B' ' 378' ' ' ILE . 43.0 m-85 -65.16 -49.47 69.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.539 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.412 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -39.24 -51.19 1.99 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -38.81 92.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.979 178.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.771 ' O ' HG23 ' B' ' 448' ' ' ILE . 3.5 mt-30 -64.6 -36.76 85.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.044 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.523 ' O ' ' CG1' ' B' ' 448' ' ' ILE . 0.0 OUTLIER -62.66 -51.82 65.73 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.57 179.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -63.84 -36.13 82.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.091 0.472 . . . . 0.0 110.519 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.467 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -67.44 -69.45 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.177 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.771 HG23 ' O ' ' B' ' 444' ' ' GLN . 2.9 pt -28.4 138.6 0.11 Allowed Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.843 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . 0.454 ' O ' ' O ' ' B' ' 448' ' ' ILE . 73.2 Cg_exo -43.26 177.02 0.0 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.265 0 C-N-CA 123.193 2.595 . . . . 0.0 112.548 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . 0.422 ' O ' ' O ' ' B' ' 451' ' ' SER . 0.1 OUTLIER 50.97 -176.12 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.915 179.902 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . 0.483 ' O ' ' N ' ' B' ' 453' ' ' SER . 0.3 OUTLIER 55.72 158.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.029 179.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 63.5 -69.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.732 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . 0.483 ' N ' ' O ' ' B' ' 451' ' ' SER . 0.7 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.168 -0.92 . . . . 0.0 110.768 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.737 HO2' ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.644 0 C3'-C2'-C1' 104.411 3.235 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.811 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.443 2.376 0 O4'-C1'-N19 111.213 3.013 . 0.129 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.811 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.379 0 O4'-C1'-N19 111.087 2.887 . 0.097 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.516 " O2'" " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.324 0 O4'-C1'-N19 111.324 3.124 . 0.147 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.516 " C4'" ' HB3' ' B' ' 398' ' ' PRO . . . . . . . . 0 O4'--C1' 1.439 2.103 0 O4'-C1'-N19 111.193 2.993 . 0.103 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.468 " H5'" " O2'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.664 0 C3'-C2'-C1' 104.249 3.055 . 0.021 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.478 " H2'" ' C6 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.005 0 O4'-C1'-N19 111.534 3.334 . 0.157 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.619 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.237 0 O4'-C1'-N19 111.165 2.965 . 0.192 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.619 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.443 0 O4'-C1'-N19 111.128 2.928 . 0.068 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.816 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.853 0 O4'-C1'-N19 111.21 3.01 . 0.091 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.64 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.378 0 O4'-C1'-N19 111.206 3.006 . 0.056 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.711 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.848 0 O4'-C1'-N19 111.138 2.938 . 0.03 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.711 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.328 0 C3'-C2'-C1' 104.384 3.205 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.636 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.28 0 C5'-C4'-C3' 111.234 -2.844 . 0.071 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.874 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.428 -2.105 0 C5'-C4'-C3' 110.824 -3.117 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.874 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.147 0 O4'-C1'-N19 111.284 3.084 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.592 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.432 -1.717 0 C5'-C4'-C3' 110.885 -3.077 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.665 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.888 0 C5'-C4'-C3' 111.067 -2.955 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.555 " O4'" " O2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.392 0 C5'-C4'-C3' 111.267 -2.822 . 0.352 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.816 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.913 0 C5'-C4'-C3' 110.95 -3.033 . 0.198 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.816 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.471 0 C5'-C4'-C3' 110.941 -3.039 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.817 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.117 0 C5'-C4'-C3' 111.224 -2.851 . 0.146 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.806 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.336 0 O4'-C1'-N19 111.673 3.473 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.724 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.171 0 O4'-C1'-N19 110.917 2.717 . 0.101 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.505 " H5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.362 0 O4'-C1'-N19 111.237 3.037 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.585 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.511 0 C5'-C4'-C3' 111.003 -2.998 . 0.072 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.974 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.086 0 O4'-C1'-N19 111.069 2.869 . 0.321 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.974 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.336 0 O4'-C1'-N19 111.227 3.027 . 0.173 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.874 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.267 0 O4'-C1'-N19 110.962 2.762 . 0.204 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.975 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.338 0 O4'-C1'-N19 111.241 3.041 . 0.246 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.975 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.721 0 O4'-C1'-N19 111.313 3.113 . 0.152 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.431 ' C6 ' " H2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.305 0 C5'-C4'-C3' 111.262 -2.826 . 0.465 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.459 -0.257 . . . . 0.0 112.459 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 32.4 m -134.16 76.68 1.66 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.641 0.258 . . . . 0.0 110.97 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.554 HD23 ' H ' ' B' ' 366' ' ' LEU . 0.1 OUTLIER -65.91 176.35 1.66 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.96 0.409 . . . . 0.0 110.942 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.519 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.2 OUTLIER -47.63 -69.55 0.12 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.936 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.511 ' SD ' " O2'" ' A' ' 15' ' ' ' A' . 1.7 ttp -36.17 -43.0 0.33 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.509 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -64.27 -43.27 95.34 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.85 0.357 . . . . 0.0 110.681 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.979 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -65.75 -74.87 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.438 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.549 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -33.92 -46.18 0.22 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.104 0.478 . . . . 0.0 110.571 179.826 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.581 ' HD2' ' N3 ' ' A' ' 18' ' ' ' A' . 9.5 ttp85 -60.44 -45.85 92.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.004 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.2 OUTLIER -60.17 -53.15 61.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.0 -179.244 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.714 ' N ' HD23 ' B' ' 374' ' ' LEU . 0.3 OUTLIER -56.74 -64.13 0.97 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -178.448 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.538 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.3 m-85 -78.26 -52.09 9.17 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -177.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.508 ' OG ' " O2'" ' A' ' 18' ' ' ' A' . 1.3 t -69.05 -29.15 67.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.877 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.9 OUTLIER -102.89 -35.53 8.56 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.665 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.877 HD13 ' O ' ' B' ' 377' ' ' LEU . 8.1 mm -136.01 37.44 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.538 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -121.61 81.13 0.34 Allowed Glycine 0 CA--C 1.517 0.207 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.8 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 1.1 ' CE2' HD12 ' B' ' 383' ' ' LEU . 36.1 p90 -105.11 174.37 5.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.887 0.375 . . . . 0.0 110.812 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -80.07 82.17 6.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.15 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.508 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 0.6 OUTLIER 160.71 -31.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.162 179.792 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 1.1 HD12 ' CE2' ' B' ' 380' ' ' TYR . 0.2 OUTLIER -54.21 -54.97 32.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.925 0.393 . . . . 0.0 110.468 179.784 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' B' ' 385' ' ' LEU . 5.4 tpt180 76.28 46.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.414 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.845 ' HA ' HG12 ' B' ' 406' ' ' VAL . 3.0 mt -38.82 140.22 0.38 Allowed 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -140.8 89.27 2.25 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -177.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.683 ' HE1' HD22 ' B' ' 385' ' ' LEU . 39.7 m-85 -91.87 122.76 34.7 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 177.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -114.83 118.16 57.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.396 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 8.4 m -83.81 110.16 18.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.657 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.811 HG23 HG23 ' B' ' 401' ' ' ILE . 35.9 m -115.92 149.93 18.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.16 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.657 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 88.68 58.54 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.077 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.448 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 0.0 OUTLIER -38.13 142.89 0.44 Allowed Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.507 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' B' ' 392' ' ' LYS . 7.0 Cg_exo -71.37 158.76 53.5 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.181 1.921 . . . . 0.0 113.019 -178.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.455 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 34.8 p -129.62 161.02 31.51 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.355 -179.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -85.32 14.26 5.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.563 179.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 4.7 m -136.89 9.26 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.886 178.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.402 ' CG ' ' OD1' ' B' ' 399' ' ' ASN . 0.2 OUTLIER 168.7 62.94 0.01 OUTLIER Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.785 -179.483 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.516 ' HB3' " C4'" ' A' ' 5' ' ' ' U' . 1.6 Cg_endo -42.08 -35.71 3.44 Favored 'Trans proline' 0 N--CA 1.464 -0.225 0 C-N-CA 123.687 2.925 . . . . 0.0 112.572 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.539 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.2 p-10 -29.01 121.12 0.13 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.041 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 1.3 t -131.42 162.5 30.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.053 179.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.811 HG23 HG23 ' B' ' 390' ' ' VAL . 0.0 OUTLIER -120.42 155.87 23.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.963 0.411 . . . . 0.0 111.501 -179.423 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.757 ' N ' HD13 ' B' ' 401' ' ' ILE . 0.1 OUTLIER -126.45 139.73 50.84 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.831 -179.591 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -102.26 119.86 39.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.939 0.399 . . . . 0.0 110.476 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.658 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 5.6 t -92.22 95.35 9.67 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.513 ' HA ' ' O ' ' B' ' 410' ' ' THR . 35.3 ttp180 -129.16 162.27 28.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.461 -178.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.845 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -139.64 144.56 28.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.074 -179.657 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 55.97 14.0 7.36 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.298 -0.953 . . . . 0.0 111.296 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 13.1 t70 57.51 23.01 8.67 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 120.801 0.334 . . . . 0.0 110.288 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -139.96 -0.71 1.92 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.238 -0.982 . . . . 0.0 113.703 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.675 ' HB ' HG23 ' B' ' 406' ' ' VAL . 23.3 m -142.83 117.59 9.87 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 117.237 0.518 . . . . 0.0 111.759 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.484 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 73.4 t -95.55 108.51 21.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.589 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.794 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -63.06 -37.2 86.24 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.85 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 175.21 -139.93 5.01 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.213 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.684 ' OG1' HD11 ' B' ' 401' ' ' ILE . 3.0 t -170.12 168.48 8.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.684 0.278 . . . . 0.0 110.854 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.648 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -159.99 131.84 2.8 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.497 -0.858 . . . . 0.0 112.424 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.463 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 7.7 p -119.15 146.05 24.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.873 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -154.53 144.37 11.08 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.057 -1.068 . . . . 0.0 112.992 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.452 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 5.5 ptm180 -57.01 -45.87 82.73 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.846 0.355 . . . . 0.0 111.69 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.808 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -99.34 29.41 3.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.274 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.767 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.5 OUTLIER 50.74 -45.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 179.133 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.629 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -45.24 -56.73 4.55 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 118.884 0.765 . . . . 0.0 109.247 179.884 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.873 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -42.01 -33.77 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 177.882 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.767 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -67.82 -48.62 65.72 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.047 -0.979 . . . . 0.0 109.781 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -60.9 -58.8 11.9 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 119.866 -1.159 . . . . 0.0 111.345 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.602 ' H ' HD12 ' B' ' 425' ' ' ILE . 3.4 mp -56.27 -39.55 60.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.503 179.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.576 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.8 tpt180 -61.84 -52.31 64.69 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.342 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.644 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -45.6 -42.01 10.7 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.979 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -60.28 -58.18 9.62 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.521 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.581 ' O ' ' CD2' ' B' ' 432' ' ' LEU . 2.9 tm-20 -52.92 -17.18 1.28 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.552 179.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.504 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 1.4 m-80 -81.02 -38.92 26.66 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.096 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.658 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -62.61 -45.26 93.68 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.916 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.816 ' C ' HD23 ' B' ' 432' ' ' LEU . 0.1 OUTLIER -83.29 1.86 38.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.756 179.455 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.784 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.2 OUTLIER -78.83 6.94 7.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.213 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.574 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 84.4 m-20 -130.12 83.76 2.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.89 0.376 . . . . 0.0 111.379 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.579 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.2 OUTLIER -48.27 -53.97 15.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.514 179.682 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.579 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 3.5 mmpt? -54.4 -42.21 70.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.555 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.794 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.3 OUTLIER -70.59 -34.55 72.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.805 179.21 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.592 HD22 HG13 ' B' ' 378' ' ' ILE . 7.2 mt -65.62 -63.96 0.97 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . 0.418 ' O ' ' HB3' ' B' ' 442' ' ' ALA . 44.6 t0 -54.79 -26.9 37.67 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 178.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.473 ' HB3' ' O ' ' B' ' 437' ' ' MET . 2.7 t80 -61.55 -44.0 97.83 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.499 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.42 ' CE2' ' HG2' ' B' ' 437' ' ' MET . 49.7 m-85 -69.86 -26.67 64.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.18 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' B' ' 439' ' ' ASP . . . -59.69 -48.77 80.34 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -63.36 -41.93 98.87 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.768 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.612 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -62.48 -34.5 76.96 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.115 0.483 . . . . 0.0 109.808 178.857 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.618 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -57.41 -57.82 11.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.005 179.144 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -63.74 -26.08 68.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.297 179.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' B' ' 449' ' ' PRO . . . -74.79 -76.46 0.14 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.353 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.612 HG23 ' O ' ' B' ' 444' ' ' GLN . 1.1 pt -24.89 87.26 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.998 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . 0.501 ' N ' ' O ' ' B' ' 447' ' ' ALA . 74.2 Cg_exo -51.21 -18.55 5.09 Favored 'Trans proline' 0 C--O 1.23 0.109 0 C-N-CA 123.013 2.475 . . . . 0.0 112.765 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 52.76 76.02 0.21 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.8 0.333 . . . . 0.0 110.347 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 60.4 p 60.08 -153.44 0.38 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.611 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -156.25 22.43 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.815 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 17.9 p . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.916 -179.99 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 1.01 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.433 1.597 0 C5'-C4'-C3' 110.958 -3.028 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 1.01 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.281 0 O4'-C1'-N19 111.25 3.05 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.635 " O2'" " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.533 0 C5'-C4'-C3' 111.044 -2.97 . 0.466 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 1.009 " O2'" " H5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.098 0 O4'-C1'-N19 111.503 3.303 . 0.167 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 1.009 " H5'" " O2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.191 0 O4'-C1'-N19 111.093 2.893 . 0.362 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.592 " H5'" " O2'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 C3'-C2'-C1' 104.301 3.113 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.589 " C5'" HO2' ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.839 0 O4'-C1'-N19 111.335 3.135 . 0.086 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.628 ' N4 ' ' H62' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.284 0 O4'-C1'-N19 111.246 3.046 . 0.159 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.628 ' H62' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.421 0 O4'-C1'-N19 111.033 2.833 . 0.275 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.535 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.431 -1.871 0 C5'-C4'-C3' 111.172 -2.885 . 0.03 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.612 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.437 0 O4'-C1'-N19 111.333 3.133 . 0.024 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.914 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.907 0 C5'-C4'-C3' 111.351 -2.766 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.914 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.668 0 C3'-C2'-C1' 104.578 3.42 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.77 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.539 0 C5'-C4'-C3' 111.162 -2.892 . 0.13 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.997 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -2.012 0 C5'-C4'-C3' 110.888 -3.075 . 0.01 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.997 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.138 0 O4'-C1'-N19 111.631 3.431 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.493 " O2'" " O4'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.089 0 C5'-C4'-C3' 110.843 -3.105 OUTLIER-DELTA 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.639 ' H61' " C2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.884 0 C5'-C4'-C3' 110.879 -3.08 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.553 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.13 0 C5'-C4'-C3' 111.107 -2.929 . 0.026 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.787 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.764 0 C5'-C4'-C3' 110.982 -3.012 . 0.15 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.771 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.449 0 C5'-C4'-C3' 110.896 -3.069 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.917 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.613 1.974 0 O4'-C1'-N19 111.174 2.974 . 0.018 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.71 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.109 0 O4'-C1'-N19 111.905 3.705 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.74 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.176 0 C5'-C4'-C3' 111.483 -2.678 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.432 " H5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.127 0 O4'-C1'-N19 111.463 3.263 . 0.209 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.515 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.466 0 O4'-C1'-N19 111.235 3.035 . 0.127 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.606 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.17 0 O4'-C1'-N19 111.06 2.86 . 0.108 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.642 " O2'" " C5'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.61 0 C3'-C2'-C1' 104.677 3.53 . 0.035 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.678 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.265 0 O4'-C1'-N19 111.26 3.06 . 0.169 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.941 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.443 2.397 0 O4'-C1'-N19 111.334 3.134 . 0.083 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.941 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.384 0 O4'-C1'-N19 111.454 3.254 . 0.226 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.551 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.521 0 C5'-C4'-C3' 111.199 -2.867 . 0.437 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.197 0 N-CA-C 112.582 -0.207 . . . . 0.0 112.582 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . 0.45 ' O ' ' C ' ' B' ' 366' ' ' LEU . 4.5 t -81.71 61.36 5.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.752 0.31 . . . . 0.0 110.902 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.523 ' O ' ' C ' ' B' ' 367' ' ' ASP . 0.1 OUTLIER -28.69 -45.74 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.751 -179.699 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.639 ' O ' ' HB3' ' B' ' 370' ' ' ALA . 0.5 OUTLIER -15.84 -58.07 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 O-C-N 123.742 0.651 . . . . 0.0 111.703 -179.609 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.486 ' O ' ' HG3' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -44.36 -62.36 1.2 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.017 179.23 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.514 ' N ' ' O ' ' B' ' 366' ' ' LEU . 0.2 OUTLIER -53.23 -32.95 50.84 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.37 179.114 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.791 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -58.0 -81.56 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.463 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.486 ' HG3' ' O ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -37.33 -44.82 0.63 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.129 0.49 . . . . 0.0 110.175 179.519 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.543 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.7 OUTLIER -57.26 -47.32 81.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.47 179.343 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.496 ' HA ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -57.71 -44.15 85.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.147 0.498 . . . . 0.0 111.159 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.753 ' N ' HD23 ' B' ' 374' ' ' LEU . 0.6 OUTLIER -59.16 -70.13 0.17 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -178.393 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.469 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.0 m-85 -83.36 -32.34 26.28 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -177.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -81.56 -24.79 36.32 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -178.913 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.844 ' O ' HD13 ' B' ' 378' ' ' ILE . 2.4 mm? -117.3 -18.96 9.78 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.844 HD13 ' O ' ' B' ' 377' ' ' LEU . 1.6 mm -144.12 44.99 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.832 0.349 . . . . 0.0 111.342 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.469 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -165.43 60.56 0.24 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.692 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.62 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 22.3 p90 -63.45 -56.98 11.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.776 0.322 . . . . 0.0 110.512 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.62 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 166.7 31.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.986 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.411 ' HB3' ' CE2' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -169.81 28.85 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.856 0.36 . . . . 0.0 110.981 179.806 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.574 ' O ' ' N ' ' B' ' 385' ' ' LEU . 0.2 OUTLIER -108.12 20.34 18.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.459 179.803 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.47 ' HB3' ' HA3' ' B' ' 407' ' ' GLY . 0.6 OUTLIER 26.49 37.58 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 O-C-N 123.786 0.679 . . . . 0.0 111.689 179.597 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.863 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.5 OUTLIER -67.17 130.86 44.45 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.948 0.404 . . . . 0.0 110.544 -179.805 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.577 ' O ' ' CD2' ' B' ' 386' ' ' HIS . 5.4 p-80 -167.7 133.23 1.97 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.316 0.579 . . . . 0.0 112.194 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.918 ' CE2' ' HB1' ' B' ' 427' ' ' ALA . 34.4 m-85 -85.71 -177.25 6.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.033 178.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.542 HG23 ' O ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -160.42 111.51 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.3 0.572 . . . . 0.0 111.358 178.286 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.9 m -74.61 116.13 14.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.954 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.821 HG23 HG23 ' B' ' 401' ' ' ILE . 23.9 m -126.1 151.16 32.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.582 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.532 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 79.42 49.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.474 -179.673 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.442 ' C ' ' O ' ' B' ' 391' ' ' LYS . 36.1 mttt -32.3 127.33 0.35 Allowed Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.11 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.605 ' O ' HG22 ' B' ' 394' ' ' THR . 12.3 Cg_endo -56.8 -170.77 0.03 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.723 2.282 . . . . 0.0 112.064 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.605 HG22 ' O ' ' B' ' 393' ' ' PRO . 0.1 OUTLIER -168.33 168.3 11.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.001 -179.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -71.6 -10.22 59.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.923 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 33.5 m -128.28 12.87 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 CA-C-O 121.378 0.609 . . . . 0.0 110.104 178.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.574 ' HB3' HG23 ' B' ' 394' ' ' THR . 0.2 OUTLIER -164.24 56.68 0.52 Allowed Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.913 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.571 ' HD3' ' N ' ' B' ' 397' ' ' ASP . 50.2 Cg_exo -53.75 -19.19 14.01 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.093 2.529 . . . . 0.0 113.166 -179.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.569 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 43.9 p-10 -65.09 139.57 58.73 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 121.301 0.572 . . . . 0.0 111.474 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . 0.549 ' O ' ' HA ' ' B' ' 416' ' ' VAL . 17.6 t -137.41 161.08 37.28 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.771 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.869 HD13 ' HB ' ' B' ' 416' ' ' VAL . 4.8 tp -128.79 113.04 27.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 121.18 0.514 . . . . 0.0 111.243 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.915 ' O ' HG22 ' B' ' 414' ' ' THR . 1.9 t -79.3 164.31 3.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.846 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.542 ' O ' HG23 ' B' ' 388' ' ' VAL . 1.3 mm-40 -133.23 106.36 7.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.174 0.511 . . . . 0.0 110.812 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.543 ' SG ' ' CE2' ' B' ' 387' ' ' TYR . 2.0 t -85.9 108.59 18.23 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.481 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -140.26 151.7 45.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.072 0.463 . . . . 0.0 111.375 -179.379 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.863 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -123.35 126.78 73.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.512 -179.248 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . 0.47 ' HA3' ' HB3' ' B' ' 384' ' ' ARG . . . -28.52 -35.67 0.01 OUTLIER Glycine 0 C--N 1.331 0.277 0 CA-C-N 115.652 -0.704 . . . . 0.0 113.758 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' B' ' 406' ' ' VAL . 58.9 t0 -53.36 -20.98 5.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.231 0.539 . . . . 0.0 110.151 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 101.8 42.88 2.2 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.081 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.583 HG22 HD13 ' B' ' 412' ' ' LEU . 13.9 m -137.79 133.24 33.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.921 0.391 . . . . 0.0 111.774 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.475 ' HA ' ' O ' ' B' ' 404' ' ' CYS . 42.9 t -94.63 88.13 2.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.61 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.838 HD12 ' HG3' ' B' ' 437' ' ' MET . 0.1 OUTLIER -51.47 -13.63 0.24 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.316 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.429 ' N ' ' HB3' ' B' ' 404' ' ' CYS . . . 153.51 -165.65 31.5 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 119.62 -1.276 . . . . 0.0 113.39 178.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.915 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -142.27 173.77 11.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.75 0.31 . . . . 0.0 110.563 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.712 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -146.61 98.9 0.2 Allowed Glycine 0 C--O 1.225 -0.416 0 C-N-CA 120.324 -0.941 . . . . 0.0 112.626 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.869 ' HB ' HD13 ' B' ' 401' ' ' ILE . 13.5 p -105.45 157.46 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.893 0.347 . . . . 0.0 110.193 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.788 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . 166.63 138.13 2.37 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 119.422 -1.37 . . . . 0.0 113.496 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.541 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.1 OUTLIER -47.09 -67.41 0.28 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.005 0.431 . . . . 0.0 109.957 179.403 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.784 ' O ' ' N ' ' B' ' 421' ' ' LYS . 2.1 p-10 -85.01 91.81 8.18 Favored 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 176.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.817 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.9 OUTLIER -17.74 -31.5 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -177.411 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.784 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.6 OUTLIER -44.83 -57.05 3.99 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.831 179.011 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.788 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.2 OUTLIER -44.98 -39.44 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.569 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.579 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.817 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -63.35 -37.6 87.9 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.827 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -70.31 -65.48 2.51 Favored Glycine 0 C--N 1.334 0.45 0 C-N-CA 120.206 -0.997 . . . . 0.0 111.724 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.481 ' H ' HD12 ' B' ' 425' ' ' ILE . 3.1 mp -53.76 -35.39 26.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.228 179.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.578 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 1.7 tpt180 -61.59 -53.27 58.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.002 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.918 ' HB1' ' CE2' ' B' ' 387' ' ' TYR . . . -45.51 -45.88 13.57 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.916 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.791 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -56.54 -72.39 0.08 Allowed 'General case' 0 C--O 1.238 0.467 0 CA-C-O 121.147 0.499 . . . . 0.0 110.216 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.542 ' HA ' HD21 ' B' ' 432' ' ' LEU . 19.9 mt-10 -45.61 -25.77 0.51 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.026 179.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.474 ' ND2' ' HD2' ' B' ' 426' ' ' ARG . 1.3 m-80 -72.33 -34.22 67.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.218 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.682 ' HB3' HD22 ' B' ' 374' ' ' LEU . . . -65.83 -43.96 86.98 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.451 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.886 ' CA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -101.42 25.93 7.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.021 0.439 . . . . 0.0 110.645 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.515 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 20.3 ttt180 -94.4 -9.84 34.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.07 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.444 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 3.6 m-20 -109.29 95.13 5.42 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.786 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.546 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 2.5 ptmt -56.33 -31.64 63.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.5 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.546 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 5.9 mtpt -66.15 -54.86 20.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.525 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.838 ' HG3' HD12 ' B' ' 412' ' ' LEU . 17.5 tmm? -63.86 -46.94 82.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.299 179.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.886 HD11 ' CA ' ' B' ' 432' ' ' LEU . 71.4 mt -55.24 -59.05 5.32 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.961 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -64.49 -24.68 67.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.678 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.602 ' CE2' ' CZ ' ' B' ' 441' ' ' TYR . 0.1 OUTLIER -62.28 -47.29 84.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.134 0.493 . . . . 0.0 109.783 179.561 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.602 ' CZ ' ' CE2' ' B' ' 440' ' ' PHE . 64.9 m-85 -76.94 -41.51 42.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.153 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -44.01 -45.19 7.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.97 -45.67 66.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.288 178.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.673 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -52.32 -24.52 7.66 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.652 178.86 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.612 HH11 HD11 ' B' ' 448' ' ' ILE . 0.2 OUTLIER -79.18 -66.07 0.92 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.04 -179.846 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -45.8 -25.95 0.59 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.432 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . -78.94 -53.07 7.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.861 0.362 . . . . 0.0 111.187 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.673 HG23 ' O ' ' B' ' 444' ' ' GLN . 2.9 pt -52.74 129.81 46.37 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.35 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -68.37 -176.26 1.07 Allowed 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.735 2.29 . . . . 0.0 112.389 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -139.73 80.58 1.78 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.918 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 1.3 m -130.71 -47.98 1.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.858 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.41 94.22 8.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.88 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 57.7 p . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.875 -179.918 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.862 ' H8 ' " O5'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.663 0 O4'-C1'-N19 111.262 3.062 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.528 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.349 0 O4'-C1'-N19 111.307 3.107 . 0.208 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.528 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.706 0 C3'-C2'-C1' 104.29 3.1 . 0.102 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.508 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.238 0 O4'-C1'-N19 111.171 2.971 . 0.124 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.609 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.088 0 O4'-C1'-N19 111.063 2.863 . 0.184 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.519 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.279 0 O4'-C1'-N19 111.057 2.857 . 0.096 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.671 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.14 0 O4'-C1'-N19 111.256 3.056 . 0.18 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.693 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.254 0 O4'-C1'-N19 111.133 2.933 . 0.355 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.693 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 C5'-C4'-C3' 111.122 -2.919 . 0.075 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.64 " O2'" " C5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.437 1.927 0 C5'-C4'-C3' 111.12 -2.92 . 0.123 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.64 " C5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.635 0 C5'-C4'-C3' 110.926 -3.049 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.664 " O2'" " C5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.003 0 O4'-C1'-N19 111.348 3.148 . 0.113 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.667 " O2'" " H5'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.28 0 O4'-C1'-N19 111.649 3.449 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.667 " H5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.429 -1.993 0 C5'-C4'-C3' 111.054 -2.964 . 0.027 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.889 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.251 0 C5'-C4'-C3' 110.971 -3.02 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.889 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -2.017 0 O4'-C1'-N19 111.948 3.748 OUTLIER-DELTA 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.494 " O2'" " C1'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.083 0 C5'-C4'-C3' 110.964 -3.024 OUTLIER-DELTA 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.761 " H2'" " O4'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.435 1.715 0 O4'-C1'-N19 111.207 3.007 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.761 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.832 0 O4'-C1'-N19 111.199 2.999 . 0.022 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.778 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.943 0 C5'-C4'-C3' 110.872 -3.085 OUTLIER-DELTA 0.0 OUTLIER '7D dist &a' 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.584 " C5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.817 0 O4'-C1'-N19 111.302 3.102 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.834 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.011 0 C5'-C4'-C3' 111.055 -2.963 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.67 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.314 0 O4'-C1'-N19 111.875 3.675 . 0.089 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.801 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.249 0 C5'-C4'-C3' 111.437 -2.709 . 0.068 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.645 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.345 0 O4'-C1'-N19 111.436 3.236 . 0.397 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.645 ' C6 ' ' C6 ' ' A' ' 25' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.281 0 O4'-C1'-N19 111.505 3.305 . 0.102 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.694 ' H6 ' " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.005 0 C5'-C4'-C3' 111.138 -2.908 . 0.231 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.635 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.582 0 C3'-C2'-C1' 104.829 3.699 . 0.011 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.721 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.106 0 O4'-C1'-N19 110.985 2.785 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 1.047 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.195 0 O4'-C1'-N19 111.525 3.325 . 0.287 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 1.047 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.604 0 O4'-C1'-N19 111.373 3.173 . 0.193 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.457 " O5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.396 0 O4'-C1'-N19 111.199 2.999 . 0.209 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' B' ' 366' ' ' LEU . . . . . . . . 0 N--CA 1.487 2.093 0 N-CA-C 112.604 -0.198 . . . . 0.0 112.604 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.65 80.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.797 0.332 . . . . 0.0 110.604 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.559 HD23 ' ND2' ' B' ' 369' ' ' ASN . 11.6 tp -135.0 124.84 25.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.98 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.5 OUTLIER -55.73 -63.3 1.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.174 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.474 ' HA ' ' NZ ' ' B' ' 371' ' ' LYS . 2.1 ttp -36.2 -52.67 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.355 179.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.559 ' ND2' HD23 ' B' ' 366' ' ' LEU . 1.0 OUTLIER -61.46 -42.0 98.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.161 179.387 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 1.006 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -65.41 -83.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.943 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.529 ' HB2' " O4'" ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -26.67 -49.91 0.04 OUTLIER 'General case' 0 C--O 1.235 0.301 0 O-C-N 123.428 0.455 . . . . 0.0 111.053 179.769 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.476 ' O ' ' HB2' ' B' ' 376' ' ' SER . 35.7 ttp85 -54.08 -61.97 1.96 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.359 179.168 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.575 ' HG2' HD22 ' B' ' 377' ' ' LEU . 0.0 OUTLIER -47.61 -54.53 11.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 111.09 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.469 HD11 ' CB ' ' B' ' 428' ' ' ALA . 7.7 mt -42.86 -67.85 0.24 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -178.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.536 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-30 -93.16 -48.3 6.53 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.476 ' HB2' ' O ' ' B' ' 372' ' ' ARG . 11.9 m -60.61 -13.94 17.37 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 121.259 -0.176 . . . . 0.0 111.338 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.778 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.9 OUTLIER -125.43 -29.12 3.26 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.235 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.778 HD13 ' O ' ' B' ' 377' ' ' LEU . 6.8 mm -142.88 44.2 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -178.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.536 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -142.48 74.77 0.33 Allowed Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.719 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.56 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 0.1 OUTLIER -100.41 -76.67 0.55 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.745 0.307 . . . . 0.0 110.803 179.876 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.56 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 168.1 82.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.008 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 25.1 t 176.58 -69.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.618 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.645 HD23 ' N ' ' B' ' 383' ' ' LEU . 1.6 pt? -41.99 -28.15 0.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.822 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' B' ' 407' ' ' GLY . 0.7 OUTLIER 62.93 53.27 2.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.748 -179.721 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.82 ' HG ' HG12 ' B' ' 406' ' ' VAL . 6.1 tt -76.7 127.6 33.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.664 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.52 ' N ' HD23 ' B' ' 385' ' ' LEU . 14.3 p-80 -152.07 140.83 20.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.52 0.676 . . . . 0.0 112.366 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.504 ' OH ' ' HA ' ' B' ' 428' ' ' ALA . 40.5 m-85 -91.89 160.65 15.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.869 179.347 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.66 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -136.97 138.25 46.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.118 179.067 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . 0.525 ' O ' ' CG2' ' B' ' 389' ' ' THR . 0.4 OUTLIER -100.08 113.49 26.15 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.708 -179.786 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.987 HG23 HG23 ' B' ' 401' ' ' ILE . 32.0 m -122.52 147.37 26.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.413 0.625 . . . . 0.0 111.42 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.624 ' CB ' HG22 ' B' ' 401' ' ' ILE . 9.3 tmtt? 80.55 55.97 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.961 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.444 ' C ' ' O ' ' B' ' 391' ' ' LYS . 2.8 mmtt -34.55 142.69 0.23 Allowed Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.672 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.596 ' HB2' " O2'" ' A' ' 5' ' ' ' U' . 14.6 Cg_exo -65.67 162.95 32.18 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.214 1.943 . . . . 0.0 111.845 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 22.8 p -132.29 158.99 40.43 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.855 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . 0.42 ' HB1' " H1'" ' A' ' 30' ' ' ' C' . . . -82.01 7.66 12.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.517 179.011 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . 0.767 HG23 ' OD2' ' B' ' 397' ' ' ASP . 20.5 m -128.67 -15.72 2.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.313 178.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.767 ' OD2' HG23 ' B' ' 396' ' ' VAL . 1.3 m-20 -158.83 65.41 2.88 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.543 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.45 ' HB3' " C4'" ' A' ' 5' ' ' ' U' . 74.7 Cg_exo -40.86 -40.31 3.56 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 123.607 2.871 . . . . 0.0 114.092 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.522 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 3.0 p-10 -33.74 140.7 0.05 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.049 0.452 . . . . 0.0 111.502 -178.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 2.7 m -143.23 163.0 34.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.466 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.987 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -123.74 140.92 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 121.211 0.529 . . . . 0.0 111.557 -179.273 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.851 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -102.84 179.3 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.121 179.479 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.66 ' CB ' HG23 ' B' ' 388' ' ' VAL . 0.1 OUTLIER -149.97 108.38 3.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.024 0.44 . . . . 0.0 110.531 178.902 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.903 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 1.8 t -82.55 116.88 22.17 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.598 ' HA ' ' O ' ' B' ' 410' ' ' THR . 2.5 ptm180 -152.16 172.32 16.54 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.416 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.82 HG12 ' HG ' ' B' ' 385' ' ' LEU . 3.7 m -139.86 138.37 38.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.895 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' B' ' 384' ' ' ARG . . . -35.66 -36.83 0.12 Allowed Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 116.105 -0.498 . . . . 0.0 113.326 -179.26 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -55.55 -17.51 5.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.046 0.45 . . . . 0.0 110.382 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 95.66 45.81 2.85 Favored Glycine 0 N--CA 1.445 -0.718 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.625 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.699 ' HB ' HG22 ' B' ' 406' ' ' VAL . 37.4 m -131.55 112.59 12.76 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 -179.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' B' ' 404' ' ' CYS . 30.4 t -84.43 86.64 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.416 179.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.762 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.0 OUTLIER -46.36 -23.1 0.31 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.98 -179.528 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.27 -154.51 25.4 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.042 -1.075 . . . . 0.0 113.383 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.676 HG22 HD11 ' B' ' 401' ' ' ILE . 3.3 m -155.99 154.64 31.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.73 -0.235 . . . . 0.0 110.472 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.648 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -139.94 160.81 26.28 Favored Glycine 0 C--O 1.224 -0.523 0 C-N-CA 119.691 -1.242 . . . . 0.0 113.981 -179.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.402 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 1.4 p -146.52 145.57 19.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.694 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -161.69 132.71 2.92 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.061 -1.066 . . . . 0.0 113.246 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.518 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 6.6 ttm180 -54.33 -53.58 51.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.948 0.404 . . . . 0.0 110.896 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.849 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.1 OUTLIER -79.48 -15.88 57.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.136 179.343 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.849 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.7 OUTLIER 93.23 -42.69 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.159 0 C-N-CA 123.434 0.693 . . . . 0.0 111.536 -179.514 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.577 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.1 OUTLIER -52.63 -45.89 66.82 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.01 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.778 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -52.95 -36.58 24.17 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.691 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 177.648 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.851 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -66.75 -43.4 84.23 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.556 178.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.87 -64.95 3.3 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.258 -0.972 . . . . 0.0 111.144 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.548 ' O ' ' HB3' ' B' ' 428' ' ' ALA . 53.6 mt -52.97 -41.54 41.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.852 0.358 . . . . 0.0 110.471 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.598 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 6.4 tpt180 -57.66 -55.86 29.37 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.495 ' HA ' ' OD1' ' B' ' 430' ' ' ASN . . . -40.81 -44.88 2.34 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 1.006 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -53.04 -62.96 1.31 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.648 178.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.467 ' HA ' HD11 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -48.29 -31.83 6.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.35 179.117 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.495 ' OD1' ' HA ' ' B' ' 427' ' ' ALA . 9.1 m120 -67.56 -31.69 71.93 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.785 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.903 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -70.96 -48.26 54.38 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.763 0.316 . . . . 0.0 110.643 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.928 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -89.94 14.38 12.31 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.756 179.486 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.53 ' O ' ' CG ' ' B' ' 433' ' ' ARG . 8.6 ttt-85 -86.08 3.28 43.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.426 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.513 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 3.7 t70 -126.5 92.39 3.55 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.115 0.484 . . . . 0.0 111.011 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.536 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -55.86 -32.88 64.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.668 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.536 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 15.6 mtmm -66.92 -59.22 3.7 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.518 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.762 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.9 OUTLIER -55.53 -51.78 65.89 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.286 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.928 HD11 ' HA ' ' B' ' 432' ' ' LEU . 96.0 mt -53.58 -65.65 0.53 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 178.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -42.09 -37.56 1.44 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.366 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.533 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -63.81 -42.77 97.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.633 179.439 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.559 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 50.4 m-85 -71.91 -35.8 69.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.262 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.72 -48.37 63.62 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -38.59 90.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.628 178.479 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.559 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -64.96 -23.16 67.14 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.233 179.516 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.755 ' O ' HD11 ' B' ' 448' ' ' ILE . 13.7 tpt180 -86.79 -28.57 22.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.143 -179.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -88.09 -41.33 13.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.924 0.392 . . . . 0.0 110.845 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.451 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -61.96 -46.92 87.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.08 -179.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.755 HD11 ' O ' ' B' ' 445' ' ' ARG . 0.7 OUTLIER -30.33 105.22 0.22 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.602 -179.801 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -47.08 164.92 0.1 Allowed 'Trans proline' 0 N--CA 1.465 -0.196 0 C-N-CA 122.843 2.362 . . . . 0.0 112.358 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -155.29 83.22 1.06 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.83 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . 0.43 ' O ' ' O ' ' B' ' 452' ' ' GLU . 0.3 OUTLIER 67.84 171.84 0.27 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.773 -179.809 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . 0.526 ' O ' ' CB ' ' B' ' 453' ' ' SER . 0.0 OUTLIER 60.03 139.89 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.67 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' B' ' 452' ' ' GLU . 3.4 p . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.905 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.846 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.435 1.741 0 O4'-C1'-N19 111.323 3.123 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.846 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.308 0 O4'-C1'-N19 111.308 3.108 . 0.125 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.576 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.745 0 C3'-C2'-C1' 104.917 3.797 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.576 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.262 0 O4'-C1'-N19 111.18 2.98 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.59 " O2'" ' HB2' ' B' ' 393' ' ' PRO . . . . . . . . 0 O4'--C1' 1.439 2.098 0 O4'-C1'-N19 111.137 2.937 . 0.159 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.501 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.293 0 O4'-C1'-N19 111.462 3.262 . 0.129 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.661 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.904 0 C5'-C4'-C3' 111.122 -2.918 . 0.182 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.567 ' N4 ' ' N4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.359 0 O4'-C1'-N19 111.469 3.269 . 0.158 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.65 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.263 0 O4'-C1'-N19 111.124 2.924 . 0.163 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.65 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.455 0 O4'-C1'-N19 111.229 3.029 . 0.126 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.584 " O4'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.406 0 C5'-C4'-C3' 111.349 -2.768 . 0.047 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.719 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.014 0 O4'-C1'-N19 111.477 3.277 . 0.06 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.719 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.155 0 O4'-C1'-N19 111.294 3.094 . 0.089 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.512 ' N4 ' ' C4 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.0 0 O4'-C1'-N19 111.044 2.844 . 0.503 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.874 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 P--O5' 1.611 1.83 0 C5'-C4'-C3' 111.038 -2.975 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.874 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.22 0 C5'-C4'-C3' 110.904 -3.064 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.682 " O2'" ' N9 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.366 0 C5'-C4'-C3' 111.047 -2.969 OUTLIER-EPSILON 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.682 ' N9 ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 1.961 0 C5'-C4'-C3' 111.036 -2.976 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.555 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.306 0 C5'-C4'-C3' 111.209 -2.861 . 0.068 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.631 " O2'" " C5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.742 0 O4'-C1'-N19 111.333 3.133 . 0.037 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.644 " O2'" " C5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.991 0 O4'-C1'-N19 111.296 3.096 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.833 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.922 0 O4'-C1'-N19 111.235 3.035 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.808 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.186 0 C5'-C4'-C3' 111.199 -2.868 . 0.031 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.803 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.555 0 C3'-C2'-C1' 104.873 3.747 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.442 2.359 0 O4'-C1'-N19 111.167 2.967 . 0.054 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.493 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.611 0 C3'-C2'-C1' 104.333 3.147 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.493 " O5'" " O2'" ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.127 0 O4'-C1'-N19 111.222 3.022 . 0.137 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.605 " O2'" " O5'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.436 0 C3'-C2'-C1' 104.068 2.853 . 0.09 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.605 " O5'" " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.133 0 O4'-C1'-N19 111.064 2.864 . 0.17 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.777 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.326 0 O4'-C1'-N19 111.271 3.071 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.784 " O2'" " H5'" ' A' ' 32' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.396 0 O4'-C1'-N19 111.437 3.237 . 0.411 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.784 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.508 0 C5'-C4'-C3' 111.269 -2.82 . 0.578 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.159 0 N-CA-C 112.435 -0.266 . . . . 0.0 112.435 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' B' ' 368' ' ' MET . 0.3 OUTLIER -132.5 36.03 3.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.957 0.408 . . . . 0.0 110.813 179.744 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.61 HD12 ' OE2' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -46.17 -20.42 0.1 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.846 -0.616 . . . . 0.0 112.046 -179.617 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.524 ' HA ' HG23 ' B' ' 425' ' ' ILE . 0.5 OUTLIER -42.63 -70.94 0.09 Allowed 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.033 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.487 ' HA ' ' HD2' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -29.94 -65.06 0.11 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.947 179.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.453 ' CG ' ' CE ' ' B' ' 368' ' ' MET . 2.9 m120 -42.27 -49.22 5.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.798 0.332 . . . . 0.0 110.486 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.822 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -58.95 -79.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.42 179.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.487 ' HD2' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -36.22 -40.97 0.24 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.086 0.47 . . . . 0.0 110.17 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.539 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.2 tmm_? -59.4 -63.52 1.27 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.278 179.221 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.62 ' HB3' HD22 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -45.56 -34.98 3.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.394 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.758 HD11 ' HA ' ' B' ' 428' ' ' ALA . 1.3 mt -68.44 -76.73 0.09 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.523 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.9 m-30 -84.91 21.58 1.56 Allowed 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.118 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -131.02 -36.7 1.32 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.731 0.3 . . . . 0.0 111.04 179.706 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.653 ' O ' HD13 ' B' ' 378' ' ' ILE . 2.1 mp -102.89 -27.55 12.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.161 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.653 HD13 ' O ' ' B' ' 377' ' ' LEU . 3.6 mm -139.91 37.43 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.134 0 C-N-CA 121.155 -0.218 . . . . 0.0 111.444 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.523 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -126.52 93.36 0.4 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.351 -0.928 . . . . 0.0 112.909 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.475 ' CD2' ' HG2' ' B' ' 445' ' ' ARG . 42.8 p90 -105.43 -169.72 1.64 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.712 0.292 . . . . 0.0 110.291 179.335 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.613 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -87.19 109.41 19.45 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.26 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.613 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 10.7 t 104.1 37.26 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.755 0.66 . . . . 0.0 111.782 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.541 ' CD1' ' O ' ' B' ' 378' ' ' ILE . 2.8 tt -87.43 -49.43 7.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.11 0.481 . . . . 0.0 110.056 179.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.479 ' HB3' ' HA3' ' B' ' 407' ' ' GLY . 0.0 OUTLIER 72.08 35.7 1.24 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.406 178.758 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.633 HD12 HG12 ' B' ' 406' ' ' VAL . 0.3 OUTLIER -40.21 140.8 0.56 Allowed 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.617 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.556 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 1.4 t60 -128.24 83.31 2.15 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 -178.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.591 ' CE1' ' SG ' ' B' ' 404' ' ' CYS . 3.9 m-85 -83.84 116.98 23.0 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.104 177.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.82 113.78 44.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.9 0.381 . . . . 0.0 111.074 -179.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 54.3 m -77.37 127.92 33.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.348 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.773 HG23 HG23 ' B' ' 401' ' ' ILE . 31.8 m -134.6 151.54 31.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.097 0.475 . . . . 0.0 111.448 -179.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.503 ' HB3' ' O ' ' B' ' 390' ' ' VAL . 10.7 tppt? 83.31 54.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.952 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.444 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 0.0 OUTLIER -34.95 142.83 0.24 Allowed Pre-proline 0 C--N 1.332 -0.153 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.415 179.842 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.59 ' HB2' " O2'" ' A' ' 5' ' ' ' U' . 2.7 Cg_exo -74.3 155.54 46.36 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 122.34 2.027 . . . . 0.0 113.434 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.487 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 1.7 p -138.69 165.96 25.61 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.507 -1.224 . . . . 0.0 111.762 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . 0.63 ' HB1' " H1'" ' A' ' 30' ' ' ' C' . . . -86.89 12.9 9.99 Favored 'General case' 0 CA--C 1.527 0.088 0 CA-C-O 121.33 0.586 . . . . 0.0 110.276 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 3.7 m -138.52 18.91 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.507 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.442 ' H ' ' CD ' ' B' ' 398' ' ' PRO . 0.8 OUTLIER 162.77 55.82 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.28 -179.538 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.502 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 3.9 Cg_endo -46.52 -48.79 13.0 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 123.623 2.882 . . . . 0.0 112.745 -179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.579 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -32.57 130.28 0.18 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.028 -178.814 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 13.8 m -132.58 159.51 39.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.392 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.773 HG23 HG23 ' B' ' 390' ' ' VAL . 16.8 tt -117.32 164.79 13.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.962 0.41 . . . . 0.0 111.221 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.609 HG23 ' O ' ' B' ' 415' ' ' GLY . 0.2 OUTLIER -135.69 138.67 47.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.013 -179.001 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.494 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 6.5 mt-10 -101.35 126.15 48.07 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 178.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.591 ' SG ' ' CE1' ' B' ' 387' ' ' TYR . 19.0 t -109.03 102.35 11.34 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.883 ' HB3' HG22 ' B' ' 411' ' ' VAL . 17.9 ptt180 -143.45 111.47 6.12 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.352 0.596 . . . . 0.0 111.485 -178.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.826 HG13 HD21 ' B' ' 412' ' ' LEU . 10.2 m -59.05 150.3 5.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.597 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . 0.479 ' HA3' ' HB3' ' B' ' 384' ' ' ARG . . . -52.5 -15.72 3.13 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.003 -0.999 . . . . 0.0 113.908 -179.129 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.14 -2.92 14.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.794 0.33 . . . . 0.0 110.564 179.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 86.74 41.79 6.66 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.618 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.547 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 21.5 m -140.72 125.37 17.95 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.803 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.883 HG22 ' HB3' ' B' ' 405' ' ' ARG . 54.9 t -87.46 112.58 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.309 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.826 HD21 HG13 ' B' ' 406' ' ' VAL . 1.2 mm? -67.75 -41.02 84.03 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . -177.42 -149.05 7.61 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.573 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.494 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -151.08 173.94 13.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.733 0.301 . . . . 0.0 110.906 -179.803 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.609 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -162.09 122.65 1.12 Allowed Glycine 0 C--O 1.227 -0.327 0 C-N-CA 120.186 -1.007 . . . . 0.0 113.066 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.412 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 6.4 p -126.67 149.42 31.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.805 0.336 . . . . 0.0 110.606 179.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.932 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -163.5 158.08 30.42 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.024 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . . . . . . . . . 8.8 ptt180 -63.2 -42.26 99.28 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.859 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.9 OUTLIER -101.46 30.15 4.41 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 179.418 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.745 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.55 -43.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 115.37 1.618 . . . . 0.0 115.37 178.402 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.624 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -48.91 -47.29 43.49 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 -179.711 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.932 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -49.45 -38.34 12.33 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.541 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.745 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -61.92 -48.32 80.98 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.627 178.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.478 ' HA2' HG21 ' B' ' 402' ' ' VAL . . . -63.33 -65.36 3.13 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.319 -0.943 . . . . 0.0 111.404 179.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.524 HG23 ' HA ' ' B' ' 367' ' ' ASP . 0.8 OUTLIER -50.37 -32.76 9.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.893 0.377 . . . . 0.0 109.994 178.925 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.593 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 27.6 tpt180 -65.46 -48.07 73.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.929 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.526 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -48.91 -42.1 35.83 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.822 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -58.07 -60.1 4.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.707 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.61 ' OE2' HD12 ' B' ' 366' ' ' LEU . 14.6 mm-40 -48.73 -33.09 9.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.012 179.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.494 ' ND2' ' O ' ' B' ' 414' ' ' THR . 1.2 m-80 -65.02 -39.08 92.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.289 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.53 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -62.33 -41.75 98.81 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.156 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.686 HD23 HD21 ' B' ' 374' ' ' LEU . 0.3 OUTLIER -87.33 0.37 55.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.795 179.414 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.473 ' O ' ' HG2' ' B' ' 433' ' ' ARG . 54.8 ttt-85 -88.28 16.45 6.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.977 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.438 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 9.6 m-20 -129.21 76.54 1.73 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.131 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.5 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -51.4 -32.54 26.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.097 0.475 . . . . 0.0 109.87 179.524 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.5 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -69.82 -42.37 73.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.092 179.642 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.489 ' HE2' HD12 ' B' ' 412' ' ' LEU . 13.2 tmm? -76.89 -44.73 30.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.027 179.243 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.634 HD11 ' HA ' ' B' ' 432' ' ' LEU . 68.1 mt -52.84 -67.69 0.23 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -53.36 -42.66 67.08 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.681 179.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.5 ' HB3' ' O ' ' B' ' 436' ' ' LYS . 2.5 t80 -53.7 -32.52 52.19 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.544 ' OH ' HG21 ' B' ' 406' ' ' VAL . 3.7 m-85 -78.7 -30.37 46.01 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.03 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -52.87 -39.52 62.69 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 177.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.15 -42.09 60.49 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.248 177.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.737 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -63.21 -13.8 41.73 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.406 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.686 ' O ' HD11 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -90.41 -46.35 8.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.665 -179.877 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -69.28 -36.22 76.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.129 0.49 . . . . 0.0 109.933 179.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.474 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -74.94 -80.1 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.477 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.737 HG23 ' O ' ' B' ' 444' ' ' GLN . 0.2 OUTLIER 27.14 94.69 0.04 OUTLIER Pre-proline 0 N--CA 1.463 0.188 0 CA-C-O 121.197 0.522 . . . . 0.0 111.601 -179.328 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . 0.453 ' O ' ' HB2' ' B' ' 450' ' ' ARG . 63.0 Cg_endo -87.11 -17.57 3.0 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 123.185 2.59 . . . . 0.0 112.623 -179.471 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . 0.453 ' HB2' ' O ' ' B' ' 449' ' ' PRO . 0.0 OUTLIER 74.15 31.93 1.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.862 -179.845 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 66.2 m -110.91 176.69 4.93 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.919 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -127.23 120.42 28.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.923 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.84 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.932 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.67 0 O4'-C1'-N19 111.175 2.975 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.932 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.244 0 O4'-C1'-N19 111.359 3.159 . 0.182 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.585 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.593 0 C3'-C2'-C1' 104.644 3.494 . 0.069 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.585 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.063 0 O4'-C1'-N19 111.202 3.002 . 0.167 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.833 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.021 0 C5'-C4'-C3' 111.407 -2.728 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.979 " O2'" " H5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.428 -2.113 0 O4'-C1'-N19 111.341 3.141 . 0.263 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.979 " H5'" " O2'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.91 0 C5'-C4'-C3' 111.073 -2.951 . 0.119 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.711 ' N4 ' ' N4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.529 0 O4'-C1'-N19 111.421 3.221 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.869 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.122 0 C5'-C4'-C3' 111.366 -2.756 . 0.112 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.869 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 C3'-C2'-C1' 104.67 3.522 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.636 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.576 0 C5'-C4'-C3' 111.294 -2.804 . 0.014 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.799 ' H6 ' " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.435 1.756 0 C5'-C4'-C3' 110.961 -3.026 . 0.019 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.755 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.607 0 C3'-C2'-C1' 104.636 3.485 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.647 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.381 0 C5'-C4'-C3' 111.186 -2.876 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.685 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.165 0 C5'-C4'-C3' 110.976 -3.016 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.685 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.899 0 O4'-C1'-N19 111.275 3.075 OUTLIER-EPSILON 0.067 1b . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.549 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -2.013 0 C5'-C4'-C3' 111.053 -2.965 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.612 ' N3 ' ' HG3' ' B' ' 372' ' ' ARG . . . . . . . . 0 P--O5' 1.611 1.759 0 C5'-C4'-C3' 110.996 -3.003 . 0.01 2a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.489 " H2'" ' C8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.943 0 O4'-C1'-N19 111.043 2.843 . 0.197 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.922 " H2'" " O4'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.862 0 C5'-C4'-C3' 110.928 -3.048 . 0.016 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.922 " O4'" " H2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.341 0 C3'-C2'-C1' 104.375 3.194 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.906 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.611 1.809 0 O4'-C1'-N19 111.213 3.013 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.733 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.159 0 O4'-C1'-N19 111.263 3.063 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.733 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.618 0 C3'-C2'-C1' 104.801 3.668 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.596 " O5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.249 0 O4'-C1'-N19 111.252 3.052 . 0.046 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.49 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.6 0 O4'-C1'-N19 111.019 2.819 . 0.094 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.766 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.125 0 O4'-C1'-N19 110.99 2.79 . 0.143 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.766 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.589 0 C3'-C2'-C1' 104.782 3.647 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.742 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.227 0 O4'-C1'-N19 111.019 2.819 . 0.155 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.907 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.269 0 O4'-C1'-N19 111.44 3.24 . 0.208 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.907 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.461 0 O4'-C1'-N19 111.412 3.212 . 0.237 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.587 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.408 0 C5'-C4'-C3' 111.104 -2.931 . 0.578 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.07 0 N-CA-C 112.467 -0.253 . . . . 0.0 112.467 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . 0.428 ' HA ' ' CG ' ' B' ' 369' ' ' ASN . 2.0 t 43.84 67.7 0.63 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.846 0.355 . . . . 0.0 111.08 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.568 HD12 ' HG2' ' B' ' 368' ' ' MET . 0.1 OUTLIER -74.53 -174.11 1.97 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.973 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.547 ' OD1' ' N ' ' B' ' 367' ' ' ASP . 0.2 OUTLIER -42.11 -71.5 0.08 Allowed 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.323 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.568 ' HG2' HD12 ' B' ' 366' ' ' LEU . 10.8 ptm -34.74 -43.14 0.17 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.407 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' B' ' 366' ' ' LEU . 6.2 m-80 -64.08 -49.85 70.66 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.024 0.44 . . . . 0.0 109.83 179.096 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.657 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -53.73 -78.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.107 179.042 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.501 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -32.5 -50.69 0.25 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.091 -179.587 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.612 ' HG3' ' N3 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -51.96 -45.42 64.4 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.413 179.766 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.546 ' HA ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -58.93 -52.08 67.27 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.366 0.603 . . . . 0.0 110.898 179.775 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.719 ' N ' HD23 ' B' ' 374' ' ' LEU . 1.5 mt -53.68 -73.85 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -82.65 -33.67 27.73 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.541 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -82.1 -16.38 50.18 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.111 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.546 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.4 OUTLIER -120.19 -24.77 5.87 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -179.357 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.679 HG22 ' CD1' ' B' ' 383' ' ' LEU . 27.7 mm -124.13 -65.83 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 C-N-CA 120.796 -0.362 . . . . 0.0 111.949 -179.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' B' ' 374' ' ' LEU . . . -56.29 79.06 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.459 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.696 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 2.5 p90 -60.55 -41.46 94.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.498 0.19 . . . . 0.0 111.169 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.696 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 154.99 -20.3 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.893 0.378 . . . . 0.0 111.169 179.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 1.7 m -127.29 39.62 3.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.69 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.679 ' CD1' HG22 ' B' ' 378' ' ' ILE . 0.5 OUTLIER -99.2 -36.3 9.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.068 -179.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 76.52 48.27 0.07 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.051 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.669 ' HA ' HG12 ' B' ' 406' ' ' VAL . 9.6 tt -89.39 143.11 27.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.56 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.406 ' NE2' ' HG3' ' B' ' 405' ' ' ARG . 14.3 p-80 -164.12 138.27 5.57 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.481 0.658 . . . . 0.0 112.576 -179.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.624 ' HE1' HD21 ' B' ' 385' ' ' LEU . 15.2 m-85 -98.48 142.14 30.46 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.077 178.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.786 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -122.29 116.72 49.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.896 -179.793 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 18.2 m -60.0 85.99 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 177.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.983 HG13 HG23 ' B' ' 401' ' ' ILE . 1.6 p -83.43 132.15 32.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.25 -0.887 . . . . 0.0 111.448 -177.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.537 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.9 OUTLIER 90.88 132.88 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.546 -178.348 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.488 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 1.5 mmmm -85.56 123.06 73.19 Favored Pre-proline 0 N--CA 1.464 0.244 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.343 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.488 ' HD3' ' HA ' ' B' ' 392' ' ' LYS . 2.9 Cg_exo -74.64 164.07 34.53 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.979 2.453 . . . . 0.0 113.357 -179.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.436 HG23 ' O ' ' B' ' 397' ' ' ASP . 0.6 OUTLIER -107.74 -158.74 0.66 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.342 179.769 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -89.13 -48.53 7.33 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.551 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . 0.596 HG11 " O4'" ' A' ' 31' ' ' ' U' . 2.7 m -111.74 -13.1 11.38 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-O 121.658 0.742 . . . . 0.0 110.266 179.161 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.564 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 0.8 OUTLIER -115.44 44.95 0.39 Allowed Pre-proline 0 C--N 1.318 -0.776 0 CA-C-N 114.53 -1.213 . . . . 0.0 110.966 179.888 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' B' ' 397' ' ' ASP . 13.7 Cg_exo -45.67 -22.21 1.09 Allowed 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.533 2.156 . . . . 0.0 112.062 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' B' ' 398' ' ' PRO . 0.2 OUTLIER -20.26 88.64 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.295 0 O-C-N 123.665 0.603 . . . . 0.0 111.233 179.997 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . 0.479 ' N ' ' O ' ' B' ' 398' ' ' PRO . 18.0 t -119.21 159.87 23.23 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.283 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.983 HG23 HG13 ' B' ' 390' ' ' VAL . 13.6 tt -112.26 160.61 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-O 121.476 0.655 . . . . 0.0 111.003 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.789 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.4 OUTLIER -120.25 142.04 37.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.786 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.786 ' CB ' HG23 ' B' ' 388' ' ' VAL . 0.3 OUTLIER -106.11 121.33 43.94 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.461 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.565 ' O ' ' N ' ' B' ' 412' ' ' LEU . 2.6 m -101.76 105.93 16.87 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.49 ' HA ' ' O ' ' B' ' 410' ' ' THR . 1.6 ptm180 -138.01 -179.94 6.07 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.364 0.602 . . . . 0.0 112.357 -178.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.684 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -148.63 139.75 17.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.02 -179.431 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . 0.465 ' O ' ' CG ' ' B' ' 408' ' ' ASP . . . 56.29 16.29 14.06 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.15 -1.024 . . . . 0.0 110.737 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . 0.47 ' O ' ' OD1' ' B' ' 408' ' ' ASP . 1.9 p30 55.29 32.98 19.74 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.226 0.536 . . . . 0.0 110.336 -179.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -140.26 -26.64 0.23 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.517 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.684 ' HB ' HG23 ' B' ' 406' ' ' VAL . 44.6 m -121.24 110.92 16.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 117.143 0.471 . . . . 0.0 112.226 -179.234 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.484 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 60.1 t -86.53 111.63 21.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.336 178.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.815 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.3 OUTLIER -66.85 -37.74 85.03 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.248 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . -178.67 -143.44 5.25 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.452 -0.88 . . . . 0.0 112.408 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.792 ' OG1' HD11 ' B' ' 401' ' ' ILE . 11.5 t -176.1 170.1 2.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.557 0.218 . . . . 0.0 110.886 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.489 ' O ' HG13 ' B' ' 401' ' ' ILE . . . -161.18 146.43 12.29 Favored Glycine 0 C--O 1.226 -0.398 0 C-N-CA 120.348 -0.929 . . . . 0.0 112.804 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.845 HG22 ' HB ' ' B' ' 401' ' ' ILE . 54.7 t -121.34 155.05 25.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.813 0.339 . . . . 0.0 110.704 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.903 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -165.05 141.32 6.97 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.128 -1.034 . . . . 0.0 113.117 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.474 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -63.62 -41.54 98.27 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.722 0.296 . . . . 0.0 111.047 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.839 ' H ' HD11 ' B' ' 422' ' ' ILE . 8.6 p30 -102.47 29.68 5.09 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.684 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 47.81 -44.42 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 178.629 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.604 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -48.37 -48.95 36.31 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 119.116 0.871 . . . . 0.0 108.676 -179.398 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.903 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.52 -38.21 5.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.533 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.789 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -66.29 -43.2 86.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.493 178.163 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.48 -67.25 2.14 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.774 -0.727 . . . . 0.0 111.978 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.441 HG12 ' HG2' ' B' ' 421' ' ' LYS . 5.0 mm -50.25 -59.38 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.825 0.345 . . . . 0.0 111.205 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.586 ' HG3' ' N ' ' B' ' 427' ' ' ALA . 0.0 OUTLIER -49.36 -44.47 44.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.21 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.586 ' N ' ' HG3' ' B' ' 426' ' ' ARG . . . -47.4 -51.67 19.11 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.657 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -52.22 -50.9 61.04 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.828 179.15 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.496 ' HA ' ' CG ' ' B' ' 432' ' ' LEU . 40.2 mt-10 -56.22 -34.16 66.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.882 179.023 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.4 OUTLIER -59.91 -41.06 90.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.461 179.344 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.435 ' HB2' ' OH ' ' B' ' 387' ' ' TYR . . . -64.13 -42.55 96.77 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.234 0.54 . . . . 0.0 110.295 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.705 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.3 OUTLIER -84.26 7.03 20.54 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.482 179.328 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 10.0 mtt180 -94.86 14.3 21.95 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.084 0.468 . . . . 0.0 110.969 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.554 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 67.4 m-20 -125.73 78.27 1.73 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.821 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.553 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 8.6 ptpt -46.85 -53.55 11.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.047 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.553 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.3 mttt -55.65 -40.54 72.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 0.0 110.695 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.815 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.1 OUTLIER -71.91 -46.7 56.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.317 179.546 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.705 HD11 ' HA ' ' B' ' 432' ' ' LEU . 72.2 mt -57.95 -61.69 2.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.002 179.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -54.27 -33.23 58.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.906 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' B' ' 437' ' ' MET . 5.8 t80 -59.21 -38.57 80.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.493 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.625 ' CE1' HD21 ' B' ' 383' ' ' LEU . 53.2 m-85 -79.42 -27.2 41.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.112 179.029 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -59.66 -52.48 65.35 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.9 -47.17 86.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 177.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.519 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -59.82 -17.01 32.76 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.15 178.591 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.502 ' O ' HG12 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -78.73 -48.41 14.97 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.343 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -75.22 -30.4 60.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.562 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.468 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -73.12 -79.99 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.239 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.519 HG23 ' O ' ' B' ' 444' ' ' GLN . 0.2 OUTLIER 28.22 94.8 0.04 OUTLIER Pre-proline 0 N--CA 1.463 0.225 0 CA-C-O 121.146 0.498 . . . . 0.0 111.489 -179.533 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . 0.423 ' O ' ' CB ' ' B' ' 450' ' ' ARG . 83.0 Cg_endo -79.23 -5.8 14.52 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.986 2.458 . . . . 0.0 112.72 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . 0.423 ' CB ' ' O ' ' B' ' 449' ' ' PRO . 0.0 OUTLIER 77.29 101.72 0.07 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.684 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 80.4 p -167.15 56.01 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.059 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -111.72 13.64 21.12 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.902 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.978 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.712 " O2'" ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.637 0 C3'-C2'-C1' 104.787 3.653 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.712 ' H8 ' " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.272 0 O4'-C1'-N19 111.206 3.006 . 0.035 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.505 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.495 0 C5'-C4'-C3' 111.02 -2.987 . 0.101 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.538 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.125 0 C5'-C4'-C3' 111.127 -2.915 . 0.074 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.632 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 P--O5' 1.613 2.026 0 O4'-C1'-N19 111.183 2.983 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.536 HO2' " C5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.365 0 C5'-C4'-C3' 111.118 -2.921 . 0.1 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.712 ' N4 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 P--O5' 1.611 1.827 0 C5'-C4'-C3' 111.139 -2.908 . 0.06 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.712 ' N4 ' ' N4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.563 0 C3'-C2'-C1' 104.554 3.393 . 0.195 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.978 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.168 0 O4'-C1'-N19 111.015 2.815 . 0.128 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.978 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.711 0 C3'-C2'-C1' 104.615 3.461 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.643 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.486 0 C5'-C4'-C3' 111.171 -2.886 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.791 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.803 0 C5'-C4'-C3' 111.152 -2.899 . 0.039 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.791 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.525 0 C3'-C2'-C1' 104.634 3.482 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.657 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.407 0 C5'-C4'-C3' 111.158 -2.895 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.875 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 1.96 0 C5'-C4'-C3' 110.934 -3.044 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.875 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.158 0 O4'-C1'-N19 111.275 3.075 OUTLIER-EPSILON 0.0 OUTLIER '7D dist 1b' 0.0 . . . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.776 ' N7 ' H5'' ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.95 0 C5'-C4'-C3' 110.701 -3.199 OUTLIER-EPSILON 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.697 ' P ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.926 0 C5'-C4'-C3' 111.093 -2.938 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.631 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.296 0 C5'-C4'-C3' 111.053 -2.964 . 0.344 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.777 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.807 0 O4'-C1'-N19 111.183 2.983 . 0.257 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.777 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.519 0 C5'-C4'-C3' 111.073 -2.951 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.689 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.875 0 O4'-C1'-N19 111.176 2.976 . 0.054 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.911 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.182 0 O4'-C1'-N19 111.217 3.017 . 0.018 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.911 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.438 0 C3'-C2'-C1' 104.431 3.257 . 0.234 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.434 ' C8 ' " H2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.308 0 O4'-C1'-N19 111.171 2.971 . 0.243 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.499 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.563 0 O4'-C1'-N19 111.094 2.894 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.971 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.081 0 O4'-C1'-N19 111.029 2.829 . 0.232 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.971 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.376 0 C3'-C2'-C1' 104.633 3.481 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.752 " H2'" " O4'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.286 0 O4'-C1'-N19 111.151 2.951 . 0.105 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.993 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.273 0 O4'-C1'-N19 111.46 3.26 . 0.126 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.993 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.418 -2.876 0 C3'-C2'-C1' 104.574 3.415 . 0.071 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.447 " O5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.54 0 O4'-C1'-N19 111.161 2.961 . 0.175 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . 0.428 ' O ' ' HB3' ' B' ' 365' ' ' SER . . . . . . . . 0 N--CA 1.489 2.196 0 N-CA-C 112.374 -0.291 . . . . 0.0 112.374 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . 0.456 ' O ' ' N ' ' B' ' 367' ' ' ASP . 20.7 t 70.76 25.34 4.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.916 0.389 . . . . 0.0 110.81 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.563 HD12 ' HB2' ' B' ' 369' ' ' ASN . 0.1 OUTLIER -36.12 -32.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.112 -179.904 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.663 ' O ' ' HB3' ' B' ' 370' ' ' ALA . 3.4 p30 -30.14 -37.7 0.02 OUTLIER 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.965 -179.029 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.542 ' HE3' ' N ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -54.37 -55.16 31.34 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.824 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.563 ' HB2' HD12 ' B' ' 366' ' ' LEU . 16.1 m120 -55.18 -37.74 67.44 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.663 ' HB3' ' O ' ' B' ' 367' ' ' ASP . . . -49.87 -78.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.746 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -41.68 -42.16 2.45 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.33 0.586 . . . . 0.0 109.939 179.606 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.59 ' HG3' ' N3 ' ' A' ' 18' ' ' ' A' . 13.7 ttp180 -55.64 -46.82 77.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.484 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.563 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -57.29 -47.07 82.43 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.437 0.637 . . . . 0.0 110.49 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.755 ' N ' HD23 ' B' ' 374' ' ' LEU . 1.3 mt -51.63 -70.57 0.08 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.58 -179.029 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.449 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.3 m-85 -84.97 -42.08 15.27 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -177.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.9 OUTLIER -65.41 -29.3 69.98 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.563 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 4.3 mm? -110.94 -44.58 3.59 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.886 -179.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.549 HG13 ' CD2' ' B' ' 438' ' ' LEU . 0.9 OUTLIER -118.45 51.59 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.983 0.421 . . . . 0.0 111.432 -179.185 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.449 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -140.22 44.6 1.05 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.219 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.697 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 23.5 p90 -91.03 -45.93 8.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.678 0.275 . . . . 0.0 111.169 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.697 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 160.85 -168.0 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.266 0.555 . . . . 0.0 111.638 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 5.7 t 43.91 22.27 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.562 -0.745 . . . . 0.0 112.083 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.769 ' CD1' HD12 ' B' ' 385' ' ' LEU . 2.0 pt? -127.39 -0.49 6.3 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.485 ' HB2' ' HA2' ' B' ' 407' ' ' GLY . 1.3 mmt180 29.95 49.48 0.06 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.344 179.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.769 HD12 ' CD1' ' B' ' 383' ' ' LEU . 0.4 OUTLIER -59.94 129.76 43.39 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 121.073 0.464 . . . . 0.0 111.411 -179.505 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.581 ' O ' ' CD2' ' B' ' 386' ' ' HIS . 24.0 p-80 -167.79 108.88 0.59 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.154 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.511 ' HA ' ' HA ' ' B' ' 404' ' ' CYS . 2.8 m-85 -55.76 175.55 0.08 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.149 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.42 ' N ' ' O ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -157.54 101.87 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.743 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 31.4 m -77.18 106.32 8.83 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.661 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.723 HG23 HG23 ' B' ' 401' ' ' ILE . 28.4 m -112.42 150.43 14.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 0.0 110.678 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.654 ' HB3' HG22 ' B' ' 401' ' ' ILE . 8.2 tppt? 72.44 48.97 0.22 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.38 -179.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' B' ' 391' ' ' LYS . 2.2 mtmt -33.79 143.64 0.18 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.194 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.595 ' HB2' " O2'" ' A' ' 5' ' ' ' U' . 32.3 Cg_exo -58.23 179.98 0.15 Allowed 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.954 2.436 . . . . 0.0 112.499 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.532 ' OG1' ' N ' ' B' ' 397' ' ' ASP . 0.1 OUTLIER -160.84 155.42 23.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.089 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . 0.634 ' HB1' " H1'" ' A' ' 30' ' ' ' C' . . . -59.24 -23.27 62.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.138 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . 0.844 HG12 " O2'" ' A' ' 30' ' ' ' C' . 2.8 m -123.96 13.44 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.234 0.54 . . . . 0.0 110.264 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.541 ' N ' ' HD3' ' B' ' 398' ' ' PRO . 0.8 OUTLIER -157.51 51.96 0.53 Allowed Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.468 179.645 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.541 ' HD3' ' N ' ' B' ' 397' ' ' ASP . 85.4 Cg_exo -46.65 -29.02 7.14 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.788 2.325 . . . . 0.0 112.396 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.498 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 20.8 p-10 -53.27 132.0 38.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.258 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -135.37 144.33 46.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.123 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 1.03 HD12 ' O ' ' B' ' 415' ' ' GLY . 0.6 OUTLIER -107.29 100.17 10.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-O 121.213 0.53 . . . . 0.0 111.223 -179.463 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.819 HG23 ' HB1' ' B' ' 423' ' ' ALA . 0.4 OUTLIER -72.39 163.2 4.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.048 179.716 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.513 ' HG2' ' N ' ' B' ' 404' ' ' CYS . 44.9 tt0 -148.9 158.49 44.21 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.79 ' O ' ' O ' ' B' ' 411' ' ' VAL . 24.3 t -132.49 130.72 40.83 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 178.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -129.79 126.99 39.43 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 123.697 0.623 . . . . 0.0 110.776 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.718 ' CG2' HD22 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -124.64 134.23 67.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.516 -179.287 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . 0.485 ' HA2' ' HB2' ' B' ' 384' ' ' ARG . . . 64.18 5.78 17.06 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.754 -0.736 . . . . 0.0 111.866 -179.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 66.48 68.61 0.43 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 163.87 -46.51 0.31 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.113 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.589 ' HB ' HG23 ' B' ' 406' ' ' VAL . 12.0 m -86.78 113.47 22.64 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.79 ' O ' ' O ' ' B' ' 404' ' ' CYS . 3.9 t -76.6 -60.93 1.91 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 -177.026 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.735 ' HG ' ' HE2' ' B' ' 437' ' ' MET . 0.1 OUTLIER 63.9 -39.2 0.21 Allowed 'General case' 0 C--N 1.315 -0.893 0 O-C-N 120.144 -1.598 . . . . 0.0 111.569 -178.51 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.587 ' HA2' ' HB3' ' B' ' 430' ' ' ASN . . . -112.97 127.5 7.97 Favored Glycine 0 C--N 1.35 1.326 0 C-N-CA 119.511 -1.328 . . . . 0.0 113.774 -179.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.523 ' N ' ' OD1' ' B' ' 430' ' ' ASN . 0.2 OUTLIER -165.84 63.16 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.709 0.29 . . . . 0.0 111.295 179.431 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 1.03 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -109.82 172.81 16.18 Favored Glycine 0 C--O 1.226 -0.368 0 C-N-CA 120.407 -0.901 . . . . 0.0 113.667 -178.411 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.463 HG22 ' H ' ' B' ' 417' ' ' GLY . 5.7 p -131.96 166.76 28.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.583 0.23 . . . . 0.0 110.628 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.75 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -172.81 116.25 0.6 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.092 -1.052 . . . . 0.0 113.184 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.489 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -43.69 -68.2 0.22 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.713 0.292 . . . . 0.0 110.386 179.324 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.893 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.2 OUTLIER -66.6 -20.57 66.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 179.039 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.893 HG23 ' O ' ' B' ' 419' ' ' ASN . 1.1 pp 102.29 -39.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 124.387 1.075 . . . . 0.0 111.37 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -49.63 -52.04 33.49 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.75 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.75 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.49 -33.27 2.96 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.519 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 177.417 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.819 ' HB1' HG23 ' B' ' 402' ' ' VAL . . . -74.22 -34.44 63.69 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.75 -1.113 . . . . 0.0 110.478 179.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -70.58 -56.24 7.71 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.149 -1.024 . . . . 0.0 111.152 178.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.574 ' O ' ' HB3' ' B' ' 428' ' ' ALA . 3.5 mp -63.77 -42.93 97.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.729 0.299 . . . . 0.0 110.446 179.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.576 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 17.8 tpt180 -53.51 -53.01 57.59 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.596 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -51.57 -40.23 59.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.574 ' HB3' ' O ' ' B' ' 425' ' ' ILE . . . -52.49 -74.21 0.04 OUTLIER 'General case' 0 C--O 1.236 0.393 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.551 ' HA ' ' HG ' ' B' ' 432' ' ' LEU . 3.3 mt-10 -43.04 -36.28 1.55 Allowed 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.587 ' HB3' ' HA2' ' B' ' 413' ' ' GLY . 0.3 OUTLIER -53.2 -36.86 61.42 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.263 178.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.568 ' O ' ' HE1' ' B' ' 437' ' ' MET . . . -83.51 -18.96 36.67 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 120.911 0.386 . . . . 0.0 110.782 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.596 HD22 ' HA ' ' B' ' 370' ' ' ALA . 0.8 OUTLIER -115.81 21.58 13.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.177 0.513 . . . . 0.0 109.965 178.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' B' ' 429' ' ' GLU . 38.0 mtt-85 -109.63 3.15 20.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.043 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.454 ' OD2' ' HA ' ' B' ' 412' ' ' LEU . 43.8 m-20 -106.37 77.07 1.18 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.303 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.539 ' HG3' ' N ' ' B' ' 436' ' ' LYS . 5.5 ptpp? -38.89 -48.08 1.51 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.558 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.539 ' N ' ' HG3' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -57.57 -51.56 68.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.043 -179.716 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.735 ' HE2' ' HG ' ' B' ' 412' ' ' LEU . 15.4 tmm? -61.43 -56.59 18.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.146 0.498 . . . . 0.0 110.0 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.549 ' CD2' HG13 ' B' ' 378' ' ' ILE . 60.4 mt -47.81 -64.77 0.7 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.882 178.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -54.92 -25.22 27.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.465 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.474 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -69.83 -39.08 76.67 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.362 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.555 ' HA ' ' HB2' ' B' ' 444' ' ' GLN . 32.4 m-85 -76.01 -51.97 11.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.174 179.118 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' B' ' 445' ' ' ARG . . . -44.45 -46.31 9.56 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -40.06 91.59 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.56 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -68.64 -7.18 30.77 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.49 178.917 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.589 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.1 OUTLIER -95.71 -40.08 9.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.411 179.98 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.87 -25.07 58.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.722 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . -76.15 -50.83 13.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.656 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.56 HG23 ' O ' ' B' ' 444' ' ' GLN . 8.1 pt -45.93 139.94 5.06 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.115 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -79.39 8.23 4.02 Favored 'Trans proline' 0 N--CA 1.465 -0.206 0 C-N-CA 122.93 2.42 . . . . 0.0 112.371 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 4.6 mtt-85 -123.34 61.39 1.05 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.013 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.29 -12.77 14.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.674 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.19 50.39 1.74 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.887 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 5.0 t . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.203 -0.904 . . . . 0.0 111.065 179.955 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.725 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.955 0 O4'-C1'-N19 111.539 3.339 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.725 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 1.979 0 C5'-C4'-C3' 111.382 -2.745 . 0.17 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.589 HO2' " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.604 0 C3'-C2'-C1' 104.662 3.513 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.589 " C5'" HO2' ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.2 0 O4'-C1'-N19 111.287 3.087 . 0.07 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.749 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 1.991 0 C5'-C4'-C3' 111.291 -2.806 . 0.056 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.509 " H5'" " O2'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.606 0 C5'-C4'-C3' 111.044 -2.97 . 0.139 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.479 " H2'" ' C6 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.008 0 O4'-C1'-N19 111.49 3.29 . 0.308 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.72 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.209 0 O4'-C1'-N19 110.917 2.717 . 0.237 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.72 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.383 0 O4'-C1'-N19 111.178 2.978 . 0.254 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.683 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.435 1.772 0 C5'-C4'-C3' 110.976 -3.016 . 0.047 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.616 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.477 0 O4'-C1'-N19 111.028 2.828 . 0.041 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.817 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.757 0 O4'-C1'-N19 111.064 2.864 . 0.103 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.817 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.663 0 C3'-C2'-C1' 104.55 3.389 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.686 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.544 0 O4'-C1'-N19 111.087 2.887 . 0.072 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.686 " O4'" " H2'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.428 -2.073 0 O4'-C1'-N19 111.113 2.913 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.665 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -1.989 0 O4'-C1'-N19 111.315 3.115 OUTLIER-EPSILON 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.596 " H2'" " O4'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -2.003 0 C5'-C4'-C3' 110.797 -3.135 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.63 ' N6 ' " O2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.883 0 C5'-C4'-C3' 111.206 -2.863 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.547 " O2'" " O4'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.113 0 O4'-C1'-N19 111.2 3.0 . 0.225 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.561 " O2'" ' HG2' ' B' ' 371' ' ' LYS . . . . . . . . 0 O4'--C1' 1.439 2.062 0 C5'-C4'-C3' 111.074 -2.95 . 0.109 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.527 " H2'" ' C6 ' ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 C3'-C2'-C1' 104.331 3.146 . 0.034 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.789 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.895 0 O4'-C1'-N19 111.096 2.896 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.677 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.276 0 O4'-C1'-N19 111.943 3.743 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.837 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.157 0 C5'-C4'-C3' 111.318 -2.788 . 0.062 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.497 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.109 0 O4'-C1'-N19 111.065 2.865 . 0.425 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.514 " O2'" " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.432 0 O4'-C1'-N19 111.135 2.935 . 0.355 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.554 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.132 0 O4'-C1'-N19 111.03 2.83 . 0.128 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.633 " O2'" " C5'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.267 0 C5'-C4'-C3' 111.072 -2.952 . 0.125 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.932 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.205 0 O4'-C1'-N19 111.041 2.841 . 0.199 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.932 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.366 0 O4'-C1'-N19 111.325 3.125 . 0.19 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.67 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.679 0 C3'-C2'-C1' 104.704 3.56 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.588 " O4'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.664 0 O4'-C1'-N19 111.336 3.136 . 0.051 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.222 0 N-CA-C 112.578 -0.209 . . . . 0.0 112.578 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . 0.807 ' C ' HD23 ' B' ' 366' ' ' LEU . 58.0 p -170.8 52.0 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.835 0.35 . . . . 0.0 110.943 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.807 HD23 ' C ' ' B' ' 365' ' ' SER . 2.7 mt -116.16 -37.84 3.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.573 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.621 ' O ' ' HB3' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -20.59 -60.49 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.246 -179.047 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.575 ' CE ' ' HB3' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -48.14 -48.95 33.86 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.981 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.575 ' HB3' ' CE ' ' B' ' 368' ' ' MET . 0.5 OUTLIER -66.12 -25.72 67.12 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 178.786 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' B' ' 367' ' ' ASP . . . -58.99 -70.7 0.14 Allowed 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.561 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 0.1 OUTLIER -48.74 -33.27 9.91 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.317 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.548 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -58.88 -46.64 87.33 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.867 -1.061 . . . . 0.0 109.959 178.839 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.698 ' NE2' HD22 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -63.02 -45.54 91.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.497 -179.785 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.836 HD22 ' HB3' ' B' ' 431' ' ' ALA . 0.4 OUTLIER -57.55 -69.52 0.16 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -178.118 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.416 ' CD2' " H5'" ' A' ' 20' ' ' ' A' . 8.6 m-30 -83.93 -33.97 24.57 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -177.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.8 ' C ' HD22 ' B' ' 377' ' ' LEU . 0.2 OUTLIER -81.97 -21.25 37.26 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.601 -0.44 . . . . 0.0 112.152 -178.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.822 ' O ' HD13 ' B' ' 378' ' ' ILE . 2.3 mm? -123.83 -6.59 7.93 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.603 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.822 HD13 ' O ' ' B' ' 377' ' ' LEU . 9.3 mm -145.6 -117.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-O 119.341 -0.361 . . . . 0.0 111.411 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.527 ' C ' ' O ' ' B' ' 378' ' ' ILE . . . -0.68 68.28 0.0 OUTLIER Glycine 0 C--N 1.346 1.096 0 N-CA-C 114.393 0.517 . . . . 0.0 114.393 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.596 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 0.1 OUTLIER -82.58 -78.07 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.02 0.438 . . . . 0.0 111.494 -179.764 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.596 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 164.36 50.28 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.091 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -147.34 6.55 0.86 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.623 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.66 ' H ' HD13 ' B' ' 383' ' ' LEU . 0.0 OUTLIER -152.42 18.51 0.63 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.179 0.514 . . . . 0.0 110.77 179.834 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 32.77 73.56 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.671 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.882 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.2 OUTLIER -59.52 114.17 2.57 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 177.791 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -122.2 102.46 8.15 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -176.157 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.778 ' OH ' ' HB2' ' B' ' 431' ' ' ALA . 13.2 m-85 -76.43 165.37 24.92 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 175.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.84 HG23 ' O ' ' B' ' 403' ' ' GLU . 0.2 OUTLIER -148.52 167.95 3.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 C-N-CA 120.131 -0.628 . . . . 0.0 111.003 178.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 7.7 m -130.54 118.12 20.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.92 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.926 HG23 HG23 ' B' ' 401' ' ' ILE . 20.3 m -130.03 153.4 38.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.799 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.504 ' HB3' HG22 ' B' ' 401' ' ' ILE . 0.1 OUTLIER 65.61 61.24 0.69 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.22 -179.779 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.19 139.19 56.08 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.472 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.577 ' HA ' ' HA ' ' B' ' 398' ' ' PRO . 11.0 Cg_endo -56.25 -172.89 0.04 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.574 2.183 . . . . 0.0 112.311 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.564 ' O ' ' HB2' ' B' ' 395' ' ' ALA . 54.9 p -157.02 -81.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.298 -0.41 . . . . 0.0 112.071 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . 0.564 ' HB2' ' O ' ' B' ' 394' ' ' THR . . . 167.76 -25.3 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 -179.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -116.22 -2.51 10.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.556 0.693 . . . . 0.0 110.16 178.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.438 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 1.3 m-20 179.06 56.39 0.06 OUTLIER Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 114.766 -1.106 . . . . 0.0 109.638 179.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.577 ' HA ' ' HA ' ' B' ' 393' ' ' PRO . 10.4 Cg_endo -54.57 -77.31 0.02 OUTLIER 'Trans proline' 0 CA--C 1.519 -0.251 0 C-N-CA 123.252 2.635 . . . . 0.0 112.884 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.55 ' O ' ' O ' ' B' ' 398' ' ' PRO . 0.4 OUTLIER 44.84 115.43 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.142 -179.542 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . 0.477 ' HB3' ' HA ' ' B' ' 420' ' ' ILE . 2.0 t -113.21 117.33 31.58 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.733 179.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.926 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -108.04 106.61 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 CA-C-O 121.305 0.574 . . . . 0.0 110.663 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.807 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.3 OUTLIER -77.96 158.58 4.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.099 179.756 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.84 ' O ' HG23 ' B' ' 388' ' ' VAL . 7.2 tp10 -128.78 89.48 2.89 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.191 178.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.728 ' O ' ' O ' ' B' ' 411' ' ' VAL . 0.4 OUTLIER -82.42 114.83 21.13 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 178.076 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.528 ' HA ' ' O ' ' B' ' 411' ' ' VAL . 17.5 ptt85 -155.8 169.42 24.42 Favored 'General case' 0 C--O 1.226 -0.154 0 O-C-N 124.224 0.952 . . . . 0.0 109.744 -178.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 1.051 HG13 HD21 ' B' ' 412' ' ' LEU . 23.7 m -127.27 126.43 67.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.829 0.347 . . . . 0.0 111.772 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . -35.05 -33.9 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 CA-C-N 115.709 -0.678 . . . . 0.0 113.314 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' B' ' 406' ' ' VAL . 15.1 t0 -59.47 -29.19 67.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.975 0.417 . . . . 0.0 110.675 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 118.03 47.26 0.44 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 121.038 -0.601 . . . . 0.0 111.769 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.625 ' HB ' HG22 ' B' ' 406' ' ' VAL . 0.2 OUTLIER -142.45 112.68 7.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.727 0.298 . . . . 0.0 111.402 -179.241 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.728 ' O ' ' O ' ' B' ' 404' ' ' CYS . 20.8 t -59.17 -63.7 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 1.051 HD21 HG13 ' B' ' 406' ' ' VAL . 0.0 OUTLIER 86.09 -42.55 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 O-C-N 121.485 -0.759 . . . . 0.0 109.31 -178.336 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.518 ' O ' ' CB ' ' B' ' 404' ' ' CYS . . . 167.46 175.15 37.15 Favored Glycine 0 C--N 1.339 0.736 0 C-N-CA 119.61 -1.281 . . . . 0.0 113.742 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.49 ' OG1' ' N ' ' B' ' 415' ' ' GLY . 0.0 OUTLIER -142.63 -177.64 5.39 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.481 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.784 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -158.07 117.34 0.77 Allowed Glycine 0 C--O 1.223 -0.555 0 C-N-CA 118.742 -1.694 . . . . 0.0 114.273 -179.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.462 ' HA ' ' O ' ' B' ' 400' ' ' SER . 38.3 t -107.45 145.07 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 178.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.595 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -166.91 145.94 10.36 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 119.531 -1.319 . . . . 0.0 113.467 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -53.31 36.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 110.653 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.901 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.5 OUTLIER -79.73 -21.83 44.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.24 179.512 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.901 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.8 OUTLIER 99.07 -41.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 C-N-CA 124.038 0.935 . . . . 0.0 111.429 -179.215 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.592 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -50.32 -42.2 52.39 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.436 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.63 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -56.72 -37.23 51.97 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.656 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 177.717 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.807 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -71.42 -31.55 67.37 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.145 179.061 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -71.39 -67.14 1.95 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.199 -1.001 . . . . 0.0 111.168 178.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.587 HD13 ' HG2' ' B' ' 421' ' ' LYS . 2.9 mp -51.66 -46.65 38.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 121.068 0.461 . . . . 0.0 110.207 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.566 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.4 tpt180 -54.25 -43.56 71.03 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.217 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.47 ' HB1' ' HE2' ' B' ' 387' ' ' TYR . . . -52.62 -49.99 63.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.175 179.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' B' ' 431' ' ' ALA . . . -54.75 -72.2 0.07 Allowed 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.22 0.533 . . . . 0.0 110.11 179.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.522 ' HG3' ' HB2' ' B' ' 370' ' ' ALA . 2.8 mt-10 -45.31 -28.02 0.76 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.936 179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.53 ' ND2' ' HG3' ' B' ' 426' ' ' ARG . 0.6 OUTLIER -68.02 -34.12 75.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.333 179.4 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.836 ' HB3' HD22 ' B' ' 374' ' ' LEU . . . -65.24 -47.46 76.7 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 179.308 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.834 ' CA ' HD11 ' B' ' 438' ' ' LEU . 0.7 OUTLIER -88.28 20.23 3.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.565 179.667 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 8.4 ttt-85 -90.02 1.02 56.78 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.039 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.541 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 95.2 m-20 -114.69 76.09 0.97 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.67 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.449 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -39.33 -45.38 1.43 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.124 -179.716 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.449 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.2 mmpt? -63.36 -53.48 51.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.922 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.573 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -60.14 -37.36 79.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.122 0.487 . . . . 0.0 109.97 179.501 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.834 HD11 ' CA ' ' B' ' 432' ' ' LEU . 58.6 mt -66.53 -55.62 14.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.213 179.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -64.62 -25.9 68.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.821 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.517 ' CE2' ' CE1' ' B' ' 441' ' ' TYR . 0.2 OUTLIER -69.4 -41.47 76.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.17 0.51 . . . . 0.0 109.663 179.34 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.542 ' CD1' ' OH ' ' B' ' 380' ' ' TYR . 16.0 m-85 -71.99 -39.87 68.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.707 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -54.79 -40.05 69.06 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . 0.453 ' O ' ' HE3' ' B' ' 443' ' ' LYS . 0.1 OUTLIER -69.94 -53.91 15.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.501 179.067 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.587 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -53.55 -30.38 41.55 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.182 0.515 . . . . 0.0 110.004 179.653 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.82 ' HD2' HD11 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -66.72 -53.74 30.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.681 179.697 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -61.52 -24.41 66.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.251 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.14 -53.55 5.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.191 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.82 HD11 ' HD2' ' B' ' 445' ' ' ARG . 15.4 pt -42.11 113.59 1.24 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.151 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -76.34 -166.69 0.39 Allowed 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 122.645 2.23 . . . . 0.0 111.994 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . 0.518 ' NH1' ' HB2' ' B' ' 450' ' ' ARG . 0.0 OUTLIER -142.57 104.32 4.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.939 0.399 . . . . 0.0 110.992 179.962 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -151.4 137.78 18.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.611 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.08 162.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.583 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 76.7 p . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.242 -0.885 . . . . 0.0 110.799 179.985 . . . . . . . . 0 0 . 1 stop_ save_