data_2msu_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 2msu _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . 0.449 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 4.6 t . . . . . 0 N--CA 1.494 1.759 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -93.72 16.68 13.4 Favored 'General case' 0 C--N 1.278 -2.535 0 CA-C-O 122.666 1.222 . . . . 0.0 108.751 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -130.08 -9.62 4.31 Favored 'General case' 0 C--N 1.273 -2.738 0 N-CA-C 104.847 -2.279 . . . . 0.0 104.847 177.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.94 -31.43 56.61 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 114.281 -1.327 . . . . 0.0 107.762 178.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -70.57 -9.2 56.24 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.3 t -116.65 20.22 14.15 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -124.5 10.88 8.55 Favored 'General case' 0 C--N 1.281 -2.405 0 CA-C-O 123.26 1.505 . . . . 0.0 108.735 -177.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.573 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.5 tp -119.43 -62.2 1.53 Allowed 'General case' 0 C--N 1.259 -3.359 0 CA-C-N 113.098 -1.865 . . . . 0.0 106.046 -177.454 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.454 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 9.9 pt-20 -56.5 -32.35 64.97 Favored 'General case' 0 C--N 1.282 -2.333 0 CA-C-O 122.861 1.315 . . . . 0.0 108.815 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.1 tp -70.81 -27.95 32.23 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.684 0 CA-C-N 114.135 -1.393 . . . . 0.0 110.384 -177.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.5 t -112.5 -9.72 13.77 Favored 'General case' 0 C--N 1.266 -3.036 0 CA-C-N 113.78 -1.555 . . . . 0.0 111.503 -177.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.573 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.7 tp . . . . . 0 C--N 1.29 -1.981 0 N-CA-C 105.765 -1.939 . . . . 0.0 105.765 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . 0.448 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 13.8 t . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.926 0.869 . . . . 0.0 109.532 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.3 t0 -96.16 15.86 19.71 Favored 'General case' 0 C--N 1.278 -2.509 0 CA-C-O 122.532 1.158 . . . . 0.0 108.453 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -123.55 -12.9 7.65 Favored 'General case' 0 C--N 1.271 -2.829 0 N-CA-C 105.008 -2.219 . . . . 0.0 105.008 177.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -73.26 -27.19 61.43 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.307 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.424 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -78.35 -10.46 59.69 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 351' ' ' SER . . . . . 0.429 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 23.0 t -113.27 10.44 18.49 Favored 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.255 15.7 t70 -107.72 6.91 28.11 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-O 123.822 1.773 . . . . 0.0 107.689 -179.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.525 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.315 0.2 OUTLIER -106.24 -53.14 2.68 Favored 'General case' 0 C--N 1.257 -3.441 0 CA-C-N 112.061 -2.336 . . . . 0.0 106.849 -177.794 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.491 ' N ' ' CD2' ' A' ' 353' ' ' LEU . 18.8 pt-20 -51.17 -34.24 30.61 Favored 'General case' 0 C--N 1.283 -2.304 0 CA-C-N 113.598 -1.637 . . . . 0.0 108.676 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . 0.49 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -70.37 -15.3 18.96 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.374 0 CA-C-N 113.547 -1.66 . . . . 0.0 110.181 -178.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.4 t -134.22 -4.75 2.69 Favored 'General case' 0 C--N 1.282 -2.349 0 C-N-CA 119.59 -0.844 . . . . 0.0 112.883 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 353' ' ' LEU . 9.8 tp . . . . . 0 C--N 1.284 -2.24 0 N-CA-C 104.726 -2.324 . . . . 0.0 104.726 177.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . 0.466 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 4.7 t . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 122.476 1.131 . . . . 0.0 108.862 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . 0.445 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 5.6 t0 -90.46 14.38 13.18 Favored 'General case' 0 C--N 1.278 -2.503 0 CA-C-O 122.232 1.015 . . . . 0.0 108.925 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.7 -9.89 9.27 Favored 'General case' 0 C--N 1.274 -2.71 0 N-CA-C 105.53 -2.026 . . . . 0.0 105.53 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -77.2 -33.65 56.29 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 114.701 -1.136 . . . . 0.0 108.18 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.445 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -69.97 -9.24 54.45 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 28.6 t -115.2 20.26 15.06 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -124.84 11.54 8.39 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.237 1.494 . . . . 0.0 108.625 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.3 tp -119.56 -61.7 1.59 Allowed 'General case' 0 C--N 1.259 -3.366 0 CA-C-N 113.132 -1.849 . . . . 0.0 106.25 -177.463 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.444 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 14.0 pt-20 -56.52 -29.14 61.53 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-N 114.079 -1.419 . . . . 0.0 108.95 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.1 tp -75.59 -23.28 16.58 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.643 0 CA-C-N 113.881 -1.509 . . . . 0.0 110.551 -177.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.1 t -118.69 -11.15 9.88 Favored 'General case' 0 C--N 1.269 -2.907 0 CA-C-N 113.835 -1.529 . . . . 0.0 112.677 -176.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.54 ' N ' ' O ' ' A' ' 353' ' ' LEU . 7.9 tp . . . . . 0 C--N 1.286 -2.16 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . 0.456 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 4.6 t . . . . . 0 N--CA 1.496 1.845 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -95.71 17.69 14.51 Favored 'General case' 0 C--N 1.279 -2.476 0 CA-C-O 122.849 1.309 . . . . 0.0 108.55 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . 0.419 ' H ' ' H ' ' A' ' 349' ' ' ALA . . . -131.84 -9.79 3.5 Favored 'General case' 0 C--N 1.272 -2.78 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 177.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . 0.419 ' H ' ' H ' ' A' ' 348' ' ' ALA . . . -75.92 -33.27 59.88 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.124 -1.398 . . . . 0.0 107.6 178.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -68.4 -9.23 46.9 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.6 t -117.36 20.67 13.52 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -125.43 11.33 8.02 Favored 'General case' 0 C--N 1.279 -2.458 0 CA-C-O 123.315 1.531 . . . . 0.0 108.521 -177.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.592 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.257 4.5 tp -118.75 -61.97 1.59 Allowed 'General case' 0 C--N 1.258 -3.383 0 CA-C-N 113.019 -1.901 . . . . 0.0 106.083 -177.561 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.447 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 18.5 pt-20 -55.96 -32.31 63.76 Favored 'General case' 0 C--N 1.283 -2.309 0 CA-C-O 122.942 1.353 . . . . 0.0 108.851 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . 0.407 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.87 -27.8 31.56 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.675 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.446 -177.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -113.05 -9.52 13.55 Favored 'General case' 0 C--N 1.267 -3.006 0 CA-C-N 113.721 -1.581 . . . . 0.0 111.503 -177.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.592 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.9 tp . . . . . 0 C--N 1.289 -2.025 0 N-CA-C 105.774 -1.935 . . . . 0.0 105.774 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . 0.435 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 5.4 t . . . . . 0 N--CA 1.494 1.737 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -95.32 17.78 13.76 Favored 'General case' 0 C--N 1.279 -2.495 0 CA-C-O 122.828 1.299 . . . . 0.0 108.525 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . 0.408 ' H ' ' H ' ' A' ' 349' ' ' ALA . . . -134.16 -8.34 2.64 Favored 'General case' 0 C--N 1.272 -2.762 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 177.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . 0.408 ' H ' ' H ' ' A' ' 348' ' ' ALA . . . -78.58 -33.47 47.61 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 114.044 -1.435 . . . . 0.0 107.461 178.482 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -67.74 -8.84 38.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 29.2 t -116.76 21.18 13.56 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -128.56 9.02 5.95 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.34 1.543 . . . . 0.0 108.523 -177.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -118.85 -61.74 1.61 Allowed 'General case' 0 C--N 1.259 -3.347 0 CA-C-N 113.092 -1.867 . . . . 0.0 105.985 -177.634 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.453 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.0 pt-20 -56.55 -31.99 64.71 Favored 'General case' 0 C--N 1.283 -2.297 0 CA-C-O 122.889 1.328 . . . . 0.0 108.872 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.3 tp -70.88 -27.48 30.44 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.642 0 CA-C-N 114.11 -1.405 . . . . 0.0 110.331 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.5 t -113.63 -9.49 13.21 Favored 'General case' 0 C--N 1.268 -2.969 0 CA-C-N 113.777 -1.556 . . . . 0.0 111.755 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.9 tp . . . . . 0 C--N 1.288 -2.068 0 N-CA-C 105.677 -1.971 . . . . 0.0 105.677 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . 0.428 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t . . . . . 0 N--CA 1.487 1.417 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . 0.465 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 1.0 OUTLIER -94.67 12.74 26.64 Favored 'General case' 0 C--N 1.276 -2.614 0 CA-C-N 113.671 -1.604 . . . . 0.0 107.058 179.652 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -118.8 -11.43 9.78 Favored 'General case' 0 C--N 1.276 -2.627 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 178.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.98 -34.91 57.52 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.588 -1.187 . . . . 0.0 108.379 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.465 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -69.1 -9.75 54.21 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.0 t -113.44 19.67 16.73 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -126.15 12.65 7.72 Favored 'General case' 0 C--N 1.279 -2.465 0 CA-C-O 123.493 1.616 . . . . 0.0 108.067 -177.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.591 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.262 4.7 tp -117.99 -61.49 1.67 Allowed 'General case' 0 C--N 1.26 -3.307 0 CA-C-N 112.79 -2.005 . . . . 0.0 106.045 -177.569 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.441 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 12.2 pt-20 -55.76 -32.67 63.63 Favored 'General case' 0 C--N 1.283 -2.29 0 CA-C-O 122.943 1.354 . . . . 0.0 108.857 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . 0.411 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.74 -27.25 30.03 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.712 0 CA-C-N 113.967 -1.469 . . . . 0.0 110.436 -177.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -113.84 -9.06 13.13 Favored 'General case' 0 C--N 1.266 -3.035 0 CA-C-N 113.804 -1.543 . . . . 0.0 111.32 -177.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.591 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.7 tp . . . . . 0 C--N 1.288 -2.066 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . 0.469 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t . . . . . 0 N--CA 1.495 1.817 0 CA-C-O 122.784 1.278 . . . . 0.0 107.684 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . 0.451 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 2.3 t0 -88.25 14.35 9.58 Favored 'General case' 0 C--N 1.276 -2.605 0 CA-C-O 122.147 0.975 . . . . 0.0 109.076 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.69 -9.28 9.37 Favored 'General case' 0 C--N 1.274 -2.689 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 178.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -78.2 -31.64 49.55 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.121 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.451 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -72.27 -9.82 58.98 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 22.9 t -113.52 17.63 18.2 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -121.07 15.03 11.52 Favored 'General case' 0 C--N 1.279 -2.475 0 CA-C-O 123.585 1.66 . . . . 0.0 107.844 -177.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.598 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.268 4.6 tp -117.19 -61.08 1.76 Allowed 'General case' 0 C--N 1.259 -3.332 0 CA-C-N 112.553 -2.112 . . . . 0.0 106.023 -177.538 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.437 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.1 pt-20 -55.43 -33.8 63.89 Favored 'General case' 0 C--N 1.283 -2.304 0 CA-C-O 122.965 1.364 . . . . 0.0 108.791 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . 0.416 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 3.8 tp -69.49 -27.18 33.11 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.667 0 CA-C-N 114.013 -1.449 . . . . 0.0 110.535 -178.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -114.22 -8.7 12.92 Favored 'General case' 0 C--N 1.266 -3.057 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.404 -177.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.598 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.4 tp . . . . . 0 C--N 1.289 -2.052 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . 0.466 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 4.4 t . . . . . 0 N--CA 1.494 1.747 0 CA-C-O 122.206 1.003 . . . . 0.0 108.568 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -94.76 17.42 13.58 Favored 'General case' 0 C--N 1.28 -2.438 0 CA-C-O 122.607 1.194 . . . . 0.0 108.789 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -129.18 -10.8 4.71 Favored 'General case' 0 C--N 1.272 -2.802 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 177.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -75.76 -25.42 56.47 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 114.299 -1.319 . . . . 0.0 108.068 178.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -77.63 -11.38 59.86 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 30.1 t -112.75 9.2 19.09 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.261 47.1 t0 -107.36 8.85 29.88 Favored 'General case' 0 C--N 1.281 -2.372 0 CA-C-O 123.829 1.776 . . . . 0.0 107.577 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.423 HD22 ' N ' ' A' ' 354' ' ' GLU 0.319 0.0 OUTLIER -106.22 -56.55 2.17 Favored 'General case' 0 C--N 1.257 -3.417 0 CA-C-N 111.93 -2.396 . . . . 0.0 106.377 -177.654 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.472 ' CG ' ' N ' ' A' ' 355' ' ' ILE . 17.9 pt-20 -49.79 -32.29 13.63 Favored 'General case' 0 C--N 1.278 -2.542 0 CA-C-N 113.145 -1.843 . . . . 0.0 108.823 -178.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . 0.472 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -72.93 -17.27 18.08 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.307 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.666 -178.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 1.8 t -128.88 -12.98 4.7 Favored 'General case' 0 C--N 1.282 -2.351 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -173.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.404 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.281 -2.385 0 N-CA-C 105.517 -2.031 . . . . 0.0 105.517 178.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . 0.462 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.8 t . . . . . 0 N--CA 1.496 1.847 0 CA-C-O 122.402 1.096 . . . . 0.0 108.258 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . 0.407 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.1 t70 -93.77 14.55 18.94 Favored 'General case' 0 C--N 1.278 -2.502 0 CA-C-O 122.481 1.134 . . . . 0.0 108.619 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -123.92 -10.04 7.72 Favored 'General case' 0 C--N 1.273 -2.725 0 N-CA-C 105.091 -2.189 . . . . 0.0 105.091 177.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.35 -31.66 58.2 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.474 -1.239 . . . . 0.0 108.091 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.407 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.4 pt? -71.26 -9.74 58.61 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 31.0 t -114.96 19.27 15.93 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -123.75 13.29 9.26 Favored 'General case' 0 C--N 1.279 -2.459 0 CA-C-O 123.481 1.61 . . . . 0.0 108.07 -177.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.571 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.264 4.2 tp -117.38 -60.08 1.87 Allowed 'General case' 0 C--N 1.259 -3.332 0 CA-C-N 112.773 -2.012 . . . . 0.0 106.105 -177.378 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.433 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.1 pt-20 -57.17 -32.67 66.67 Favored 'General case' 0 C--N 1.282 -2.332 0 CA-C-O 123.052 1.406 . . . . 0.0 108.865 179.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . 0.406 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.99 -26.71 28.04 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.65 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.509 -177.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.3 t -113.26 -12.19 13.11 Favored 'General case' 0 C--N 1.266 -3.036 0 CA-C-N 113.826 -1.534 . . . . 0.0 111.461 -177.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.571 ' N ' ' O ' ' A' ' 353' ' ' LEU . 2.6 tm? . . . . . 0 C--N 1.288 -2.066 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . 0.418 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 5.4 t . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -99.54 16.2 24.08 Favored 'General case' 0 C--N 1.276 -2.594 0 CA-C-O 122.976 1.369 . . . . 0.0 107.789 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -128.46 -10.79 5.12 Favored 'General case' 0 C--N 1.272 -2.785 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 177.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -74.96 -32.63 61.75 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.319 -1.309 . . . . 0.0 107.99 178.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -70.21 -9.05 54.62 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.0 t -117.38 20.53 13.57 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -124.63 11.28 8.51 Favored 'General case' 0 C--N 1.28 -2.416 0 CA-C-O 123.376 1.56 . . . . 0.0 108.569 -177.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.578 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -119.45 -62.24 1.53 Allowed 'General case' 0 C--N 1.258 -3.39 0 CA-C-N 113.016 -1.902 . . . . 0.0 106.179 -177.372 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.45 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 11.2 pt-20 -55.99 -32.07 63.61 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-O 122.976 1.369 . . . . 0.0 108.894 179.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.3 tp -70.98 -28.23 32.67 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.662 0 CA-C-N 113.999 -1.455 . . . . 0.0 110.375 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.5 t -112.88 -9.36 13.65 Favored 'General case' 0 C--N 1.267 -3.003 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.764 -176.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.578 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.0 tp . . . . . 0 C--N 1.289 -2.027 0 N-CA-C 105.782 -1.933 . . . . 0.0 105.782 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . 0.46 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.2 t . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -94.6 17.07 13.95 Favored 'General case' 0 C--N 1.278 -2.5 0 CA-C-O 122.621 1.201 . . . . 0.0 108.456 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . 0.407 ' H ' ' H ' ' A' ' 349' ' ' ALA . . . -128.54 -9.27 5.12 Favored 'General case' 0 C--N 1.272 -2.78 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 177.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . 0.407 ' H ' ' H ' ' A' ' 348' ' ' ALA . . . -78.35 -22.72 47.58 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 114.294 -1.321 . . . . 0.0 108.049 178.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -80.52 -11.19 59.7 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 351' ' ' SER . . . . . 0.426 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 12.6 t -111.61 9.85 21.11 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.256 25.2 t0 -108.18 7.83 27.68 Favored 'General case' 0 C--N 1.281 -2.375 0 CA-C-O 123.891 1.805 . . . . 0.0 107.671 -179.335 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.551 ' CD2' ' N ' ' A' ' 354' ' ' GLU 0.318 0.5 OUTLIER -106.72 -53.41 2.62 Favored 'General case' 0 C--N 1.257 -3.43 0 CA-C-N 111.983 -2.372 . . . . 0.0 107.026 -177.676 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.551 ' N ' ' CD2' ' A' ' 353' ' ' LEU . 19.8 pt-20 -50.55 -34.76 26.75 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 113.563 -1.653 . . . . 0.0 108.635 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . 0.504 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -70.62 -14.87 18.48 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.338 0 CA-C-N 113.664 -1.607 . . . . 0.0 110.304 -178.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.3 t -133.97 -4.36 2.8 Favored 'General case' 0 C--N 1.28 -2.426 0 C-N-CA 119.586 -0.846 . . . . 0.0 112.583 -174.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.527 ' N ' ' O ' ' A' ' 353' ' ' LEU . 9.8 tp . . . . . 0 C--N 1.284 -2.258 0 N-CA-C 104.563 -2.384 . . . . 0.0 104.563 177.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . . . . . . . . . 41.4 t . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 122.092 0.949 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . 0.45 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.0 t0 -93.58 16.11 14.5 Favored 'General case' 0 C--N 1.272 -2.775 0 CA-C-O 122.659 1.218 . . . . 0.0 108.094 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -121.87 -14.87 7.99 Favored 'General case' 0 C--N 1.272 -2.785 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 178.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -70.66 -28.15 64.57 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.494 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.45 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -78.51 -10.36 59.68 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 351' ' ' SER . . . . . 0.42 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 43.5 t -113.5 10.77 18.24 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 179.526 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.254 34.8 t0 -107.82 7.57 28.27 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-O 123.902 1.811 . . . . 0.0 107.662 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.551 ' CD2' ' N ' ' A' ' 354' ' ' GLU 0.321 0.4 OUTLIER -106.41 -54.0 2.54 Favored 'General case' 0 C--N 1.256 -3.473 0 CA-C-N 111.988 -2.369 . . . . 0.0 107.03 -177.471 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.551 ' N ' ' CD2' ' A' ' 353' ' ' LEU . 17.2 pt-20 -50.53 -34.48 25.55 Favored 'General case' 0 C--N 1.282 -2.33 0 CA-C-N 113.911 -1.495 . . . . 0.0 108.712 179.468 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . 0.504 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.6 mt -69.31 -16.06 20.26 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.355 0 CA-C-N 113.623 -1.626 . . . . 0.0 110.128 -178.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 356' ' ' THR . . . . . 0.405 ' N ' ' O ' ' A' ' 353' ' ' LEU . 1.9 t -132.12 -5.87 3.46 Favored 'General case' 0 C--N 1.283 -2.322 0 C-N-CA 119.683 -0.807 . . . . 0.0 112.737 -174.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.506 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.286 -2.187 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 177.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . 0.462 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 4.6 t . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 122.422 1.106 . . . . 0.0 108.183 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -93.35 14.67 17.7 Favored 'General case' 0 C--N 1.278 -2.517 0 CA-C-O 122.505 1.145 . . . . 0.0 108.595 179.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -125.03 -10.15 7.13 Favored 'General case' 0 C--N 1.273 -2.739 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 177.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.2 -31.35 58.39 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.414 -1.266 . . . . 0.0 108.065 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -71.57 -9.77 58.74 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.9 t -115.28 19.14 15.77 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -122.88 13.44 9.87 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.483 1.611 . . . . 0.0 108.258 -177.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.264 5.7 tp -118.55 -63.74 1.37 Allowed 'General case' 0 C--N 1.258 -3.378 0 CA-C-N 112.763 -2.017 . . . . 0.0 105.993 -177.554 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.444 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.0 pt-20 -53.74 -32.06 50.74 Favored 'General case' 0 C--N 1.283 -2.323 0 CA-C-O 123.029 1.395 . . . . 0.0 108.999 179.234 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.1 tp -72.26 -25.63 23.61 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.663 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.69 -177.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.3 t -114.96 -13.5 11.92 Favored 'General case' 0 C--N 1.267 -3.021 0 CA-C-N 114.074 -1.421 . . . . 0.0 112.513 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.282 -2.357 0 N-CA-C 105.142 -2.17 . . . . 0.0 105.142 179.079 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . 0.45 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 4.9 t . . . . . 0 N--CA 1.494 1.753 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -97.42 18.24 15.73 Favored 'General case' 0 C--N 1.28 -2.416 0 CA-C-O 123.003 1.382 . . . . 0.0 108.205 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -133.89 -11.08 2.66 Favored 'General case' 0 C--N 1.272 -2.795 0 N-CA-C 104.358 -2.46 . . . . 0.0 104.358 177.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -74.38 -34.1 63.24 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 113.96 -1.473 . . . . 0.0 107.591 178.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -67.7 -8.75 37.69 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 27.3 t -118.45 20.63 12.96 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 123.096 1.426 . . . . 0.0 107.198 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -125.11 8.66 7.98 Favored 'General case' 0 C--N 1.279 -2.496 0 CA-C-O 123.386 1.565 . . . . 0.0 108.146 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.525 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.288 0.1 OUTLIER -113.31 -60.19 1.92 Allowed 'General case' 0 C--N 1.258 -3.372 0 CA-C-N 112.785 -2.007 . . . . 0.0 105.953 -178.638 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.457 ' N ' HD22 ' A' ' 353' ' ' LEU . 23.4 pt-20 -54.15 -34.86 61.44 Favored 'General case' 0 C--N 1.276 -2.609 0 CA-C-N 114.026 -1.443 . . . . 0.0 109.253 -178.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . 0.433 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 6.3 tp -69.04 -26.8 33.1 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.591 0 CA-C-N 113.812 -1.54 . . . . 0.0 111.061 -177.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -112.93 -15.52 12.86 Favored 'General case' 0 C--N 1.265 -3.067 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.197 -176.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.291 -1.967 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . 0.443 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t . . . . . 0 N--CA 1.488 1.439 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . 0.462 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 0.6 OUTLIER -95.39 13.49 25.64 Favored 'General case' 0 C--N 1.275 -2.672 0 CA-C-N 113.879 -1.509 . . . . 0.0 107.441 179.9 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -121.17 -11.81 8.78 Favored 'General case' 0 C--N 1.274 -2.691 0 N-CA-C 105.234 -2.136 . . . . 0.0 105.234 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.15 -25.92 55.76 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.424 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.462 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -80.28 -10.51 59.76 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 351' ' ' SER . . . . . 0.418 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 29.8 t -111.11 10.55 21.97 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.255 46.4 t0 -107.94 6.48 27.26 Favored 'General case' 0 C--N 1.281 -2.383 0 CA-C-O 123.875 1.797 . . . . 0.0 107.643 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.532 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.317 0.2 OUTLIER -105.95 -52.97 2.72 Favored 'General case' 0 C--N 1.258 -3.403 0 CA-C-N 112.011 -2.359 . . . . 0.0 106.891 -177.784 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.498 ' CG ' ' N ' ' A' ' 355' ' ' ILE . 18.6 pt-20 -51.3 -33.9 30.89 Favored 'General case' 0 C--N 1.283 -2.322 0 CA-C-N 113.661 -1.609 . . . . 0.0 108.556 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . 0.498 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.5 mt -70.31 -15.37 19.05 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.368 0 CA-C-N 113.5 -1.682 . . . . 0.0 110.111 -178.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.3 t -134.07 -4.74 2.74 Favored 'General case' 0 C--N 1.281 -2.374 0 C-N-CA 119.671 -0.811 . . . . 0.0 112.886 -174.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' A' ' 353' ' ' LEU . 10.4 tp . . . . . 0 C--N 1.284 -2.257 0 N-CA-C 104.783 -2.303 . . . . 0.0 104.783 177.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . 0.46 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t . . . . . 0 N--CA 1.496 1.868 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -97.35 16.53 19.8 Favored 'General case' 0 C--N 1.281 -2.388 0 CA-C-O 122.592 1.187 . . . . 0.0 108.576 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -127.56 -10.26 5.65 Favored 'General case' 0 C--N 1.272 -2.769 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.94 -24.61 52.38 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 114.286 -1.325 . . . . 0.0 108.145 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -79.22 -11.13 59.96 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 39.5 t -111.93 8.7 20.42 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.267 13.5 t70 -106.86 11.27 30.21 Favored 'General case' 0 C--N 1.282 -2.366 0 CA-C-O 123.691 1.71 . . . . 0.0 107.798 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.48 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.307 0.0 OUTLIER -107.84 -58.91 1.91 Allowed 'General case' 0 C--N 1.257 -3.432 0 CA-C-N 112.112 -2.313 . . . . 0.0 106.3 -177.242 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.476 ' CG ' ' N ' ' A' ' 355' ' ' ILE . 16.1 pt-20 -47.93 -32.58 6.55 Favored 'General case' 0 C--N 1.281 -2.376 0 CA-C-N 113.223 -1.808 . . . . 0.0 108.978 -178.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . 0.476 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.3 mt -73.34 -17.49 17.75 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.319 0 CA-C-N 113.622 -1.626 . . . . 0.0 110.658 -178.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 356' ' ' THR . . . . . 0.452 ' N ' ' O ' ' A' ' 353' ' ' LEU . 2.1 t -130.51 -11.11 4.02 Favored 'General case' 0 C--N 1.28 -2.415 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -173.031 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.48 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.281 -2.39 0 N-CA-C 105.44 -2.059 . . . . 0.0 105.44 178.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . . . . . . . . . 3.7 t . . . . . 0 N--CA 1.487 1.401 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . 0.462 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.0 t70 -96.68 13.85 26.95 Favored 'General case' 0 C--N 1.276 -2.618 0 CA-C-N 113.573 -1.648 . . . . 0.0 106.939 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -118.98 -13.72 9.42 Favored 'General case' 0 C--N 1.273 -2.726 0 N-CA-C 105.28 -2.118 . . . . 0.0 105.28 178.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -73.75 -35.21 65.0 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.554 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.462 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -69.36 -9.31 52.86 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.1 t -115.43 20.13 15.0 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -124.16 13.01 8.97 Favored 'General case' 0 C--N 1.28 -2.438 0 CA-C-O 123.39 1.567 . . . . 0.0 108.352 -177.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.577 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -118.53 -61.67 1.63 Allowed 'General case' 0 C--N 1.258 -3.391 0 CA-C-N 112.876 -1.966 . . . . 0.0 106.101 -177.412 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.448 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.1 pt-20 -56.18 -32.75 64.64 Favored 'General case' 0 C--N 1.282 -2.331 0 CA-C-O 122.952 1.358 . . . . 0.0 108.856 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . 0.4 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.0 tp -70.67 -28.04 32.97 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.693 0 CA-C-N 113.995 -1.457 . . . . 0.0 110.515 -177.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -112.51 -9.89 13.76 Favored 'General case' 0 C--N 1.265 -3.066 0 CA-C-N 113.743 -1.572 . . . . 0.0 111.404 -177.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.577 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.1 tp . . . . . 0 C--N 1.289 -2.055 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . 0.472 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 2.5 t . . . . . 0 N--CA 1.498 1.952 0 CA-C-O 122.323 1.059 . . . . 0.0 108.678 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 4.4 t70 -91.09 15.34 11.86 Favored 'General case' 0 C--N 1.279 -2.459 0 CA-C-O 122.251 1.024 . . . . 0.0 109.071 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.93 -10.91 9.02 Favored 'General case' 0 C--N 1.272 -2.782 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.56 -33.53 58.5 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.585 -1.189 . . . . 0.0 108.189 178.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.424 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -70.75 -9.67 57.82 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 27.1 t -114.45 19.53 16.11 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -123.42 13.42 9.49 Favored 'General case' 0 C--N 1.28 -2.455 0 CA-C-N 113.816 -1.538 . . . . 0.0 108.39 -177.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.541 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.3 tp -119.4 -61.86 1.57 Allowed 'General case' 0 C--N 1.26 -3.299 0 CA-C-N 113.041 -1.89 . . . . 0.0 106.252 -177.235 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.458 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.2 pt-20 -56.27 -29.24 60.86 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 114.095 -1.412 . . . . 0.0 109.041 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.0 tp -76.49 -22.57 15.29 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.685 0 CA-C-N 113.768 -1.56 . . . . 0.0 110.69 -177.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.0 t -118.78 -11.86 9.73 Favored 'General case' 0 C--N 1.27 -2.879 0 CA-C-N 113.897 -1.501 . . . . 0.0 112.527 -176.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.541 ' N ' ' O ' ' A' ' 353' ' ' LEU . 7.7 tp . . . . . 0 C--N 1.286 -2.171 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 346' ' ' VAL . . . . . 0.456 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 9.1 t . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 121.962 0.887 . . . . 0.0 109.782 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 347' ' ' ASP . . . . . 0.446 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 4.8 t70 -92.26 14.88 15.02 Favored 'General case' 0 C--N 1.277 -2.573 0 CA-C-O 122.324 1.059 . . . . 0.0 108.767 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.12 -11.0 9.31 Favored 'General case' 0 C--N 1.272 -2.768 0 N-CA-C 105.438 -2.06 . . . . 0.0 105.438 178.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.27 -33.92 59.13 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 114.606 -1.179 . . . . 0.0 108.403 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 350' ' ' LEU . . . . . 0.446 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -70.16 -8.97 54.01 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 32.6 t -115.57 20.28 14.81 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -124.64 11.68 8.53 Favored 'General case' 0 C--N 1.279 -2.472 0 CA-C-O 123.359 1.552 . . . . 0.0 108.558 -177.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 353' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.7 tp -119.51 -62.08 1.54 Allowed 'General case' 0 C--N 1.258 -3.381 0 CA-C-N 113.033 -1.894 . . . . 0.0 106.141 -177.492 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 354' ' ' GLU . . . . . 0.447 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.3 pt-20 -56.11 -32.14 63.93 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 114.274 -1.33 . . . . 0.0 108.867 179.474 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 355' ' ' ILE . . . . . 0.401 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.6 tp -71.29 -27.71 30.05 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.691 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.506 -177.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.6 t -112.97 -9.54 13.59 Favored 'General case' 0 C--N 1.266 -3.053 0 CA-C-N 113.754 -1.566 . . . . 0.0 111.542 -177.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.5 tp . . . . . 0 C--N 1.289 -2.023 0 N-CA-C 105.701 -1.963 . . . . 0.0 105.701 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 22.0 t . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 18.4 p30 -162.21 172.84 15.11 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.237 -0.915 . . . . 0.0 109.622 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . 0.42 ' O ' ' C ' ' A' ' 342' ' ' GLU . 0.0 OUTLIER -167.77 -26.77 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.283 -0.885 . . . . 0.0 109.826 -179.912 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . 0.42 ' C ' ' O ' ' A' ' 341' ' ' LYS . 0.0 OUTLIER -40.94 -83.04 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.467 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 2.1 p -92.04 -0.54 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 178.189 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.467 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 6.3 t70 75.17 -174.8 0.13 Allowed 'General case' 0 C--N 1.287 -2.149 0 CA-C-O 122.261 1.029 . . . . 0.0 110.493 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -84.28 168.59 15.54 Favored 'General case' 0 C--N 1.29 -1.992 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.28 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.449 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 4.6 t -118.79 -2.14 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -93.72 16.68 13.4 Favored 'General case' 0 C--N 1.278 -2.535 0 CA-C-O 122.666 1.222 . . . . 0.0 108.751 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -130.08 -9.62 4.31 Favored 'General case' 0 C--N 1.273 -2.738 0 N-CA-C 104.847 -2.279 . . . . 0.0 104.847 177.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.94 -31.43 56.61 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 114.281 -1.327 . . . . 0.0 107.762 178.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -70.57 -9.2 56.24 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.3 t -116.65 20.22 14.15 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -124.5 10.88 8.55 Favored 'General case' 0 C--N 1.281 -2.405 0 CA-C-O 123.26 1.505 . . . . 0.0 108.735 -177.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.573 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.5 tp -119.43 -62.2 1.53 Allowed 'General case' 0 C--N 1.259 -3.359 0 CA-C-N 113.098 -1.865 . . . . 0.0 106.046 -177.454 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.454 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 9.9 pt-20 -56.5 -32.35 64.97 Favored 'General case' 0 C--N 1.282 -2.333 0 CA-C-O 122.861 1.315 . . . . 0.0 108.815 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.1 tp -70.81 -27.95 32.23 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.684 0 CA-C-N 114.135 -1.393 . . . . 0.0 110.384 -177.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.5 t -112.5 -9.72 13.77 Favored 'General case' 0 C--N 1.266 -3.036 0 CA-C-N 113.78 -1.555 . . . . 0.0 111.503 -177.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.573 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.7 tp -109.29 -3.71 16.98 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 105.765 -1.939 . . . . 0.0 105.765 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.431 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.282 -2.331 0 CA-C-N 113.097 -1.865 . . . . 0.0 110.041 179.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 65.5 m . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . 0.51 ' N ' ' OD1' ' A' ' 340' ' ' ASP . 0.5 OUTLIER -75.86 -177.2 3.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.198 -0.939 . . . . 0.0 109.402 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . 0.407 ' O ' ' C ' ' A' ' 342' ' ' GLU . 0.0 OUTLIER -168.85 -27.24 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.25 -0.906 . . . . 0.0 109.731 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . 0.48 ' C ' ' H ' ' A' ' 344' ' ' ASP . 0.2 OUTLIER -41.91 -82.62 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.359 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.532 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 3.6 p -83.93 13.59 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 178.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.532 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 3.7 t70 83.98 -173.93 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.39 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -114.7 159.59 20.35 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-O 121.841 0.829 . . . . 0.0 109.573 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.448 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 13.8 t -149.36 -5.74 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.297 -1.709 0 CA-C-O 121.926 0.869 . . . . 0.0 109.532 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.3 t0 -96.16 15.86 19.71 Favored 'General case' 0 C--N 1.278 -2.509 0 CA-C-O 122.532 1.158 . . . . 0.0 108.453 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -123.55 -12.9 7.65 Favored 'General case' 0 C--N 1.271 -2.829 0 N-CA-C 105.008 -2.219 . . . . 0.0 105.008 177.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -73.26 -27.19 61.43 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.307 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.424 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -78.35 -10.46 59.69 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 351' ' ' SER . . . . . 0.429 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 23.0 t -113.27 10.44 18.49 Favored 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.255 15.7 t70 -107.72 6.91 28.11 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-O 123.822 1.773 . . . . 0.0 107.689 -179.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.525 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.315 0.2 OUTLIER -106.24 -53.14 2.68 Favored 'General case' 0 C--N 1.257 -3.441 0 CA-C-N 112.061 -2.336 . . . . 0.0 106.849 -177.794 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.491 ' N ' ' CD2' ' A' ' 353' ' ' LEU . 18.8 pt-20 -51.17 -34.24 30.61 Favored 'General case' 0 C--N 1.283 -2.304 0 CA-C-N 113.598 -1.637 . . . . 0.0 108.676 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . 0.49 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -70.37 -15.3 18.96 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.374 0 CA-C-N 113.547 -1.66 . . . . 0.0 110.181 -178.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.4 t -134.22 -4.75 2.69 Favored 'General case' 0 C--N 1.282 -2.349 0 C-N-CA 119.59 -0.844 . . . . 0.0 112.883 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 353' ' ' LEU . 9.8 tp -100.85 13.32 35.41 Favored 'General case' 0 C--N 1.284 -2.24 0 N-CA-C 104.726 -2.324 . . . . 0.0 104.726 177.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.286 -2.171 0 CA-C-N 113.006 -1.906 . . . . 0.0 109.515 -179.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 339' ' ' SER . . . . . 0.647 ' HG ' ' H ' ' A' ' 340' ' ' ASP . 80.8 p . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . 0.647 ' H ' ' HG ' ' A' ' 339' ' ' SER . 61.5 m-20 -49.51 -88.84 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.242 -0.911 . . . . 0.0 109.425 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.08 -27.62 0.19 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.635 0.731 . . . . 0.0 109.861 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . 0.53 ' H ' ' C ' ' A' ' 340' ' ' ASP . 0.2 OUTLIER -47.32 -81.31 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 178.821 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.474 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 2.3 p -95.35 10.06 5.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.474 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 2.1 t70 79.01 -174.8 0.07 Allowed 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.07 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -116.61 160.88 20.03 Favored 'General case' 0 C--N 1.297 -1.694 0 CA-C-O 121.917 0.865 . . . . 0.0 109.801 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.466 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 4.7 t -147.67 0.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.695 0 CA-C-O 122.476 1.131 . . . . 0.0 108.862 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . 0.445 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 5.6 t0 -90.46 14.38 13.18 Favored 'General case' 0 C--N 1.278 -2.503 0 CA-C-O 122.232 1.015 . . . . 0.0 108.925 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.7 -9.89 9.27 Favored 'General case' 0 C--N 1.274 -2.71 0 N-CA-C 105.53 -2.026 . . . . 0.0 105.53 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -77.2 -33.65 56.29 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 114.701 -1.136 . . . . 0.0 108.18 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.445 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -69.97 -9.24 54.45 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 28.6 t -115.2 20.26 15.06 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -124.84 11.54 8.39 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.237 1.494 . . . . 0.0 108.625 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.3 tp -119.56 -61.7 1.59 Allowed 'General case' 0 C--N 1.259 -3.366 0 CA-C-N 113.132 -1.849 . . . . 0.0 106.25 -177.463 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.444 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 14.0 pt-20 -56.52 -29.14 61.53 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-N 114.079 -1.419 . . . . 0.0 108.95 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.1 tp -75.59 -23.28 16.58 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.643 0 CA-C-N 113.881 -1.509 . . . . 0.0 110.551 -177.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.1 t -118.69 -11.15 9.88 Favored 'General case' 0 C--N 1.269 -2.907 0 CA-C-N 113.835 -1.529 . . . . 0.0 112.677 -176.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.54 ' N ' ' O ' ' A' ' 353' ' ' LEU . 7.9 tp -97.93 17.55 17.96 Favored 'General case' 0 C--N 1.286 -2.16 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.283 -2.32 0 CA-C-N 113.19 -1.823 . . . . 0.0 109.752 -178.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 36.1 p . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -72.27 177.79 4.3 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.212 -0.93 . . . . 0.0 109.578 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.65 113.74 26.09 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-O 122.54 1.162 . . . . 0.0 110.102 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . 0.448 ' C ' ' H ' ' A' ' 344' ' ' ASP . 0.4 OUTLIER -104.5 -85.38 0.47 Allowed 'General case' 0 C--N 1.291 -1.964 0 N-CA-C 103.636 -2.727 . . . . 0.0 103.636 176.739 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.525 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 2.7 p -87.45 6.13 3.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 N-CA-C 104.296 -2.483 . . . . 0.0 104.296 173.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.525 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 6.4 t70 90.61 -178.55 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 113.502 -1.681 . . . . 0.0 110.336 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -107.82 163.91 12.71 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-O 121.542 0.687 . . . . 0.0 109.537 -179.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.456 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 4.6 t -130.03 -2.5 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -95.71 17.69 14.51 Favored 'General case' 0 C--N 1.279 -2.476 0 CA-C-O 122.849 1.309 . . . . 0.0 108.55 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . 0.419 ' H ' ' H ' ' A' ' 349' ' ' ALA . . . -131.84 -9.79 3.5 Favored 'General case' 0 C--N 1.272 -2.78 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 177.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . 0.419 ' H ' ' H ' ' A' ' 348' ' ' ALA . . . -75.92 -33.27 59.88 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.124 -1.398 . . . . 0.0 107.6 178.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -68.4 -9.23 46.9 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.6 t -117.36 20.67 13.52 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -125.43 11.33 8.02 Favored 'General case' 0 C--N 1.279 -2.458 0 CA-C-O 123.315 1.531 . . . . 0.0 108.521 -177.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.592 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.257 4.5 tp -118.75 -61.97 1.59 Allowed 'General case' 0 C--N 1.258 -3.383 0 CA-C-N 113.019 -1.901 . . . . 0.0 106.083 -177.561 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.447 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 18.5 pt-20 -55.96 -32.31 63.76 Favored 'General case' 0 C--N 1.283 -2.309 0 CA-C-O 122.942 1.353 . . . . 0.0 108.851 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . 0.407 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.87 -27.8 31.56 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.675 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.446 -177.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -113.05 -9.52 13.55 Favored 'General case' 0 C--N 1.267 -3.006 0 CA-C-N 113.721 -1.581 . . . . 0.0 111.503 -177.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.592 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.9 tp -109.18 -3.97 16.89 Favored 'General case' 0 C--N 1.289 -2.025 0 N-CA-C 105.774 -1.935 . . . . 0.0 105.774 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.284 -2.276 0 CA-C-N 113.029 -1.896 . . . . 0.0 110.071 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 60.1 m . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . 0.525 ' C ' ' H ' ' A' ' 342' ' ' GLU . 4.8 m-20 -74.83 -141.6 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.257 -0.902 . . . . 0.0 109.273 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . 0.47 ' O ' ' C ' ' A' ' 342' ' ' GLU . 10.4 mttp 70.54 -43.94 0.56 Allowed 'General case' 0 N--CA 1.485 1.287 0 CA-C-O 121.575 0.702 . . . . 0.0 110.713 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . 0.525 ' H ' ' C ' ' A' ' 340' ' ' ASP . 0.0 OUTLIER -33.57 -80.55 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.379 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.233 179.862 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.44 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 2.3 p -95.64 -3.08 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 178.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.44 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 3.6 t70 71.99 -174.66 0.17 Allowed 'General case' 0 C--N 1.285 -2.233 0 CA-C-O 122.207 1.003 . . . . 0.0 110.47 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -102.25 166.92 10.31 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.18 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.435 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 5.4 t -114.29 -4.73 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -95.32 17.78 13.76 Favored 'General case' 0 C--N 1.279 -2.495 0 CA-C-O 122.828 1.299 . . . . 0.0 108.525 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . 0.408 ' H ' ' H ' ' A' ' 349' ' ' ALA . . . -134.16 -8.34 2.64 Favored 'General case' 0 C--N 1.272 -2.762 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 177.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . 0.408 ' H ' ' H ' ' A' ' 348' ' ' ALA . . . -78.58 -33.47 47.61 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 114.044 -1.435 . . . . 0.0 107.461 178.482 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -67.74 -8.84 38.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 29.2 t -116.76 21.18 13.56 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -128.56 9.02 5.95 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.34 1.543 . . . . 0.0 108.523 -177.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -118.85 -61.74 1.61 Allowed 'General case' 0 C--N 1.259 -3.347 0 CA-C-N 113.092 -1.867 . . . . 0.0 105.985 -177.634 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.453 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.0 pt-20 -56.55 -31.99 64.71 Favored 'General case' 0 C--N 1.283 -2.297 0 CA-C-O 122.889 1.328 . . . . 0.0 108.872 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.3 tp -70.88 -27.48 30.44 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.642 0 CA-C-N 114.11 -1.405 . . . . 0.0 110.331 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.5 t -113.63 -9.49 13.21 Favored 'General case' 0 C--N 1.268 -2.969 0 CA-C-N 113.777 -1.556 . . . . 0.0 111.755 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.9 tp -109.02 -3.74 17.2 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 105.677 -1.971 . . . . 0.0 105.677 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.404 ' O ' ' O ' ' A' ' 357' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.356 0 CA-C-N 113.114 -1.857 . . . . 0.0 110.037 179.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 54.2 p . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' A' ' 344' ' ' ASP . 0.9 OUTLIER -81.43 -1.19 44.8 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.224 -0.922 . . . . 0.0 109.441 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . 0.461 ' O ' ' C ' ' A' ' 342' ' ' GLU . 21.2 mttp -45.1 -44.29 10.33 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.895 0.855 . . . . 0.0 110.287 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . 0.461 ' C ' ' O ' ' A' ' 341' ' ' LYS . 0.4 OUTLIER -33.56 -79.65 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.252 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.494 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.427 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 3.8 p -87.72 -9.94 10.94 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.606 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.494 ' N ' ' O ' ' A' ' 340' ' ' ASP . 8.7 t70 69.95 -167.61 0.17 Allowed 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.486 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -131.3 22.55 4.8 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -179.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.428 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t -80.38 -4.07 6.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.783 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 178.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . 0.465 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 1.0 OUTLIER -94.67 12.74 26.64 Favored 'General case' 0 C--N 1.276 -2.614 0 CA-C-N 113.671 -1.604 . . . . 0.0 107.058 179.652 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -118.8 -11.43 9.78 Favored 'General case' 0 C--N 1.276 -2.627 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 178.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.98 -34.91 57.52 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.588 -1.187 . . . . 0.0 108.379 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.465 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -69.1 -9.75 54.21 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.0 t -113.44 19.67 16.73 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -126.15 12.65 7.72 Favored 'General case' 0 C--N 1.279 -2.465 0 CA-C-O 123.493 1.616 . . . . 0.0 108.067 -177.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.591 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.262 4.7 tp -117.99 -61.49 1.67 Allowed 'General case' 0 C--N 1.26 -3.307 0 CA-C-N 112.79 -2.005 . . . . 0.0 106.045 -177.569 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.441 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 12.2 pt-20 -55.76 -32.67 63.63 Favored 'General case' 0 C--N 1.283 -2.29 0 CA-C-O 122.943 1.354 . . . . 0.0 108.857 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . 0.411 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.74 -27.25 30.03 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.712 0 CA-C-N 113.967 -1.469 . . . . 0.0 110.436 -177.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -113.84 -9.06 13.13 Favored 'General case' 0 C--N 1.266 -3.035 0 CA-C-N 113.804 -1.543 . . . . 0.0 111.32 -177.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.591 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.7 tp -107.74 -4.89 17.71 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.405 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.281 -2.392 0 CA-C-N 113.008 -1.905 . . . . 0.0 109.901 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 26.7 t . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.331 0.586 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . 0.461 ' N ' ' OD1' ' A' ' 340' ' ' ASP . 21.7 p-10 -81.94 125.73 31.1 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.261 -0.899 . . . . 0.0 109.735 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . 0.475 ' O ' ' N ' ' A' ' 343' ' ' VAL . 0.0 OUTLIER 53.16 -166.77 0.07 Allowed 'General case' 0 C--N 1.304 -1.411 0 CA-C-O 121.526 0.679 . . . . 0.0 110.852 178.958 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 67.7 -65.51 0.24 Allowed 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 -178.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.502 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 0.3 OUTLIER -106.78 6.1 9.95 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.859 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 177.678 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.502 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 2.1 t70 79.49 -172.45 0.05 Allowed 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.771 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -107.15 166.95 10.24 Favored 'General case' 0 C--N 1.298 -1.65 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.654 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.469 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t -128.4 1.51 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 CA-C-O 122.784 1.278 . . . . 0.0 107.684 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . 0.451 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 2.3 t0 -88.25 14.35 9.58 Favored 'General case' 0 C--N 1.276 -2.605 0 CA-C-O 122.147 0.975 . . . . 0.0 109.076 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.69 -9.28 9.37 Favored 'General case' 0 C--N 1.274 -2.689 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 178.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -78.2 -31.64 49.55 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.121 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.451 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -72.27 -9.82 58.98 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 22.9 t -113.52 17.63 18.2 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -121.07 15.03 11.52 Favored 'General case' 0 C--N 1.279 -2.475 0 CA-C-O 123.585 1.66 . . . . 0.0 107.844 -177.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.598 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.268 4.6 tp -117.19 -61.08 1.76 Allowed 'General case' 0 C--N 1.259 -3.332 0 CA-C-N 112.553 -2.112 . . . . 0.0 106.023 -177.538 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.437 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.1 pt-20 -55.43 -33.8 63.89 Favored 'General case' 0 C--N 1.283 -2.304 0 CA-C-O 122.965 1.364 . . . . 0.0 108.791 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . 0.416 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 3.8 tp -69.49 -27.18 33.11 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.667 0 CA-C-N 114.013 -1.449 . . . . 0.0 110.535 -178.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -114.22 -8.7 12.92 Favored 'General case' 0 C--N 1.266 -3.057 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.404 -177.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.598 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.4 tp -107.26 -5.99 17.52 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.425 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.365 0 CA-C-N 113.115 -1.857 . . . . 0.0 109.983 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 39.0 m . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . 0.529 ' C ' ' H ' ' A' ' 342' ' ' GLU . 36.5 m-20 -159.35 177.36 11.08 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.217 -0.927 . . . . 0.0 109.565 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.57 -18.6 0.47 Allowed 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 122.018 0.913 . . . . 0.0 108.862 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . 0.529 ' H ' ' C ' ' A' ' 340' ' ' ASP . 0.0 OUTLIER -44.83 -77.83 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 178.969 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.599 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 6.4 p -83.31 -3.09 7.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 N-CA-C 108.42 -0.955 . . . . 0.0 108.42 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.599 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 16.5 t70 127.88 167.9 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.914 0 O-C-N 124.967 1.417 . . . . 0.0 109.829 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . 0.483 ' N ' ' CG ' ' A' ' 344' ' ' ASP . 25.3 mt-10 -99.73 162.97 12.68 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.768 0.794 . . . . 0.0 109.32 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.466 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 4.4 t -139.37 -1.47 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 CA-C-O 122.206 1.003 . . . . 0.0 108.568 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -94.76 17.42 13.58 Favored 'General case' 0 C--N 1.28 -2.438 0 CA-C-O 122.607 1.194 . . . . 0.0 108.789 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -129.18 -10.8 4.71 Favored 'General case' 0 C--N 1.272 -2.802 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 177.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -75.76 -25.42 56.47 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 114.299 -1.319 . . . . 0.0 108.068 178.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -77.63 -11.38 59.86 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 30.1 t -112.75 9.2 19.09 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.261 47.1 t0 -107.36 8.85 29.88 Favored 'General case' 0 C--N 1.281 -2.372 0 CA-C-O 123.829 1.776 . . . . 0.0 107.577 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.423 HD22 ' N ' ' A' ' 354' ' ' GLU 0.319 0.0 OUTLIER -106.22 -56.55 2.17 Favored 'General case' 0 C--N 1.257 -3.417 0 CA-C-N 111.93 -2.396 . . . . 0.0 106.377 -177.654 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.472 ' CG ' ' N ' ' A' ' 355' ' ' ILE . 17.9 pt-20 -49.79 -32.29 13.63 Favored 'General case' 0 C--N 1.278 -2.542 0 CA-C-N 113.145 -1.843 . . . . 0.0 108.823 -178.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . 0.472 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -72.93 -17.27 18.08 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.307 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.666 -178.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 356' ' ' THR . . . . . 0.431 ' C ' ' H ' ' A' ' 358' ' ' GLU . 1.8 t -128.88 -12.98 4.7 Favored 'General case' 0 C--N 1.282 -2.351 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -173.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.404 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.2 OUTLIER -95.59 15.71 19.15 Favored 'General case' 0 C--N 1.281 -2.385 0 N-CA-C 105.517 -2.031 . . . . 0.0 105.517 178.882 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.431 ' H ' ' C ' ' A' ' 356' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.283 -2.287 0 CA-C-N 113.234 -1.803 . . . . 0.0 109.573 -178.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 42.6 m . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -159.4 -176.95 6.08 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.271 -0.893 . . . . 0.0 109.619 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . 0.521 ' O ' ' N ' ' A' ' 343' ' ' VAL . 1.9 mppt? -93.03 -162.3 0.92 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.469 -0.769 . . . . 0.0 109.1 -179.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . 0.52 ' C ' ' H ' ' A' ' 344' ' ' ASP . 1.5 mt-10 67.94 -64.52 0.28 Allowed 'General case' 0 C--N 1.308 -1.219 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.521 ' N ' ' O ' ' A' ' 341' ' ' LYS . 9.8 p -69.34 0.22 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.067 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.52 ' H ' ' C ' ' A' ' 342' ' ' GLU . 1.1 t70 179.97 174.01 0.92 Allowed 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.975 -179.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . 0.477 ' N ' ' CG ' ' A' ' 344' ' ' ASP . 31.9 mt-10 -142.6 159.9 41.34 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-O 121.572 0.701 . . . . 0.0 109.727 -179.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.462 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.8 t -134.34 -0.65 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 CA-C-O 122.402 1.096 . . . . 0.0 108.258 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . 0.407 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.1 t70 -93.77 14.55 18.94 Favored 'General case' 0 C--N 1.278 -2.502 0 CA-C-O 122.481 1.134 . . . . 0.0 108.619 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -123.92 -10.04 7.72 Favored 'General case' 0 C--N 1.273 -2.725 0 N-CA-C 105.091 -2.189 . . . . 0.0 105.091 177.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.35 -31.66 58.2 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.474 -1.239 . . . . 0.0 108.091 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.407 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.4 pt? -71.26 -9.74 58.61 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 31.0 t -114.96 19.27 15.93 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -123.75 13.29 9.26 Favored 'General case' 0 C--N 1.279 -2.459 0 CA-C-O 123.481 1.61 . . . . 0.0 108.07 -177.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.571 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.264 4.2 tp -117.38 -60.08 1.87 Allowed 'General case' 0 C--N 1.259 -3.332 0 CA-C-N 112.773 -2.012 . . . . 0.0 106.105 -177.378 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.433 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.1 pt-20 -57.17 -32.67 66.67 Favored 'General case' 0 C--N 1.282 -2.332 0 CA-C-O 123.052 1.406 . . . . 0.0 108.865 179.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . 0.406 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.99 -26.71 28.04 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.65 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.509 -177.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.3 t -113.26 -12.19 13.11 Favored 'General case' 0 C--N 1.266 -3.036 0 CA-C-N 113.826 -1.534 . . . . 0.0 111.461 -177.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.571 ' N ' ' O ' ' A' ' 353' ' ' LEU . 2.6 tm? -100.37 -9.98 21.68 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 179.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.436 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.285 -2.205 0 CA-C-N 113.06 -1.882 . . . . 0.0 110.136 179.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 43.9 t . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . 0.467 ' O ' ' N ' ' A' ' 342' ' ' GLU . 0.5 OUTLIER -173.66 -35.08 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.262 -0.899 . . . . 0.0 109.366 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . 0.453 ' O ' ' C ' ' A' ' 342' ' ' GLU . 0.0 OUTLIER -45.36 -21.85 0.11 Allowed 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.798 0.809 . . . . 0.0 109.419 179.517 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . 0.467 ' N ' ' O ' ' A' ' 340' ' ' ASP . 6.8 mm-40 -35.49 -77.28 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.185 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.537 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.432 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 0.3 OUTLIER -99.27 -0.36 10.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 178.324 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.432 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 1.7 t70 69.34 -173.43 0.18 Allowed 'General case' 0 C--N 1.284 -2.264 0 CA-C-O 122.158 0.98 . . . . 0.0 110.404 179.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -68.2 175.97 2.97 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.418 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 5.4 t -109.76 -5.91 11.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 178.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -99.54 16.2 24.08 Favored 'General case' 0 C--N 1.276 -2.594 0 CA-C-O 122.976 1.369 . . . . 0.0 107.789 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -128.46 -10.79 5.12 Favored 'General case' 0 C--N 1.272 -2.785 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 177.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -74.96 -32.63 61.75 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.319 -1.309 . . . . 0.0 107.99 178.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -70.21 -9.05 54.62 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.0 t -117.38 20.53 13.57 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -124.63 11.28 8.51 Favored 'General case' 0 C--N 1.28 -2.416 0 CA-C-O 123.376 1.56 . . . . 0.0 108.569 -177.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.578 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -119.45 -62.24 1.53 Allowed 'General case' 0 C--N 1.258 -3.39 0 CA-C-N 113.016 -1.902 . . . . 0.0 106.179 -177.372 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.45 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 11.2 pt-20 -55.99 -32.07 63.61 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-O 122.976 1.369 . . . . 0.0 108.894 179.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.3 tp -70.98 -28.23 32.67 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.662 0 CA-C-N 113.999 -1.455 . . . . 0.0 110.375 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.5 t -112.88 -9.36 13.65 Favored 'General case' 0 C--N 1.267 -3.003 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.764 -176.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.578 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.0 tp -109.64 -3.34 16.91 Favored 'General case' 0 C--N 1.289 -2.027 0 N-CA-C 105.782 -1.933 . . . . 0.0 105.782 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.346 0 CA-C-N 113.093 -1.867 . . . . 0.0 110.032 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 339' ' ' SER . . . . . 0.418 ' O ' ' OD1' ' A' ' 340' ' ' ASP . 38.3 t . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . 0.418 ' OD1' ' O ' ' A' ' 339' ' ' SER . 74.5 m-20 -149.58 -30.03 0.24 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.288 -0.882 . . . . 0.0 109.323 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . 0.613 ' O ' ' N ' ' A' ' 343' ' ' VAL . 7.5 mttp 62.1 -126.98 0.73 Allowed 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.47 -0.769 . . . . 0.0 110.734 179.518 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . 0.525 ' C ' ' H ' ' A' ' 344' ' ' ASP . 0.8 OUTLIER 59.55 -68.69 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 122.422 1.106 . . . . 0.0 108.899 -179.851 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.613 ' N ' ' O ' ' A' ' 341' ' ' LYS . 6.2 p -71.23 5.47 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.112 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.27 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.525 ' H ' ' C ' ' A' ' 342' ' ' GLU . 5.9 t70 -177.43 174.66 1.55 Allowed 'General case' 0 C--N 1.283 -2.29 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.409 -179.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . 0.483 ' N ' ' CG ' ' A' ' 344' ' ' ASP . 29.7 mt-10 -131.9 166.54 21.41 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.474 0.654 . . . . 0.0 109.857 -178.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.46 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.2 t -103.37 -1.12 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 178.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -94.6 17.07 13.95 Favored 'General case' 0 C--N 1.278 -2.5 0 CA-C-O 122.621 1.201 . . . . 0.0 108.456 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . 0.407 ' H ' ' H ' ' A' ' 349' ' ' ALA . . . -128.54 -9.27 5.12 Favored 'General case' 0 C--N 1.272 -2.78 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 177.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . 0.407 ' H ' ' H ' ' A' ' 348' ' ' ALA . . . -78.35 -22.72 47.58 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 114.294 -1.321 . . . . 0.0 108.049 178.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -80.52 -11.19 59.7 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 351' ' ' SER . . . . . 0.426 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 12.6 t -111.61 9.85 21.11 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.256 25.2 t0 -108.18 7.83 27.68 Favored 'General case' 0 C--N 1.281 -2.375 0 CA-C-O 123.891 1.805 . . . . 0.0 107.671 -179.335 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.551 ' CD2' ' N ' ' A' ' 354' ' ' GLU 0.318 0.5 OUTLIER -106.72 -53.41 2.62 Favored 'General case' 0 C--N 1.257 -3.43 0 CA-C-N 111.983 -2.372 . . . . 0.0 107.026 -177.676 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.551 ' N ' ' CD2' ' A' ' 353' ' ' LEU . 19.8 pt-20 -50.55 -34.76 26.75 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 113.563 -1.653 . . . . 0.0 108.635 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . 0.504 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -70.62 -14.87 18.48 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.338 0 CA-C-N 113.664 -1.607 . . . . 0.0 110.304 -178.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.3 t -133.97 -4.36 2.8 Favored 'General case' 0 C--N 1.28 -2.426 0 C-N-CA 119.586 -0.846 . . . . 0.0 112.583 -174.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.527 ' N ' ' O ' ' A' ' 353' ' ' LEU . 9.8 tp -94.58 11.4 31.16 Favored 'General case' 0 C--N 1.284 -2.258 0 N-CA-C 104.563 -2.384 . . . . 0.0 104.563 177.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.449 ' OE1' ' N ' ' A' ' 358' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.286 -2.165 0 CA-C-N 112.96 -1.927 . . . . 0.0 109.698 -178.631 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . 0.536 ' CG ' ' H ' ' A' ' 341' ' ' LYS . 20.5 t0 -92.92 -166.13 1.47 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.22 -0.925 . . . . 0.0 109.762 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . 0.588 ' O ' ' N ' ' A' ' 343' ' ' VAL . 9.5 mptt -91.18 -151.4 0.26 Allowed 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.588 -0.695 . . . . 0.0 109.534 -179.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . 0.536 ' C ' ' H ' ' A' ' 344' ' ' ASP . 19.8 mm-40 63.32 -71.39 0.06 Allowed 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 -179.084 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.588 ' N ' ' O ' ' A' ' 341' ' ' LYS . 8.4 p -61.01 -5.96 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.023 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 177.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.536 ' H ' ' C ' ' A' ' 342' ' ' GLU . 7.0 t70 -179.63 169.57 1.34 Allowed 'General case' 0 C--N 1.288 -2.087 0 CA-C-O 121.916 0.865 . . . . 0.0 110.165 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . 0.43 ' N ' ' CG ' ' A' ' 344' ' ' ASP . 38.1 mt-10 -146.11 157.42 43.84 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.623 0.725 . . . . 0.0 109.558 -179.158 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . . . . . . . . . 41.4 t -156.09 -18.31 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 CA-C-O 122.092 0.949 . . . . 0.0 109.512 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . 0.45 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.0 t0 -93.58 16.11 14.5 Favored 'General case' 0 C--N 1.272 -2.775 0 CA-C-O 122.659 1.218 . . . . 0.0 108.094 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -121.87 -14.87 7.99 Favored 'General case' 0 C--N 1.272 -2.785 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 178.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -70.66 -28.15 64.57 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.494 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.45 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -78.51 -10.36 59.68 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 351' ' ' SER . . . . . 0.42 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 43.5 t -113.5 10.77 18.24 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 179.526 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.254 34.8 t0 -107.82 7.57 28.27 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-O 123.902 1.811 . . . . 0.0 107.662 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.551 ' CD2' ' N ' ' A' ' 354' ' ' GLU 0.321 0.4 OUTLIER -106.41 -54.0 2.54 Favored 'General case' 0 C--N 1.256 -3.473 0 CA-C-N 111.988 -2.369 . . . . 0.0 107.03 -177.471 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.551 ' N ' ' CD2' ' A' ' 353' ' ' LEU . 17.2 pt-20 -50.53 -34.48 25.55 Favored 'General case' 0 C--N 1.282 -2.33 0 CA-C-N 113.911 -1.495 . . . . 0.0 108.712 179.468 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . 0.504 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.6 mt -69.31 -16.06 20.26 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.355 0 CA-C-N 113.623 -1.626 . . . . 0.0 110.128 -178.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 356' ' ' THR . . . . . 0.405 ' N ' ' O ' ' A' ' 353' ' ' LEU . 1.9 t -132.12 -5.87 3.46 Favored 'General case' 0 C--N 1.283 -2.322 0 C-N-CA 119.683 -0.807 . . . . 0.0 112.737 -174.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.506 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.9 OUTLIER -97.91 10.55 39.97 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 177.911 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.276 -2.609 0 CA-C-N 112.671 -2.059 . . . . 0.0 109.545 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 38.4 m . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -163.74 -178.55 5.81 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.229 -0.919 . . . . 0.0 109.633 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . 0.541 ' CD ' ' N ' ' A' ' 341' ' ' LYS . 9.9 mptt -92.27 -161.86 0.87 Allowed 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.496 -0.753 . . . . 0.0 109.993 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 66.13 -66.38 0.17 Allowed 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 122.288 1.042 . . . . 0.0 108.773 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.534 ' CG1' ' N ' ' A' ' 344' ' ' ASP . 6.4 p -86.53 -40.47 14.23 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.943 0 CA-C-O 122.243 1.021 . . . . 0.0 109.169 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.534 ' N ' ' CG1' ' A' ' 343' ' ' VAL . 15.0 t0 59.12 -174.58 0.1 Allowed 'General case' 0 C--N 1.27 -2.89 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.988 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -123.08 162.64 22.04 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-O 121.657 0.741 . . . . 0.0 109.588 -179.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.462 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 4.6 t -132.11 -0.7 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 CA-C-O 122.422 1.106 . . . . 0.0 108.183 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -93.35 14.67 17.7 Favored 'General case' 0 C--N 1.278 -2.517 0 CA-C-O 122.505 1.145 . . . . 0.0 108.595 179.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -125.03 -10.15 7.13 Favored 'General case' 0 C--N 1.273 -2.739 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 177.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.2 -31.35 58.39 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.414 -1.266 . . . . 0.0 108.065 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -71.57 -9.77 58.74 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.9 t -115.28 19.14 15.77 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -122.88 13.44 9.87 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.483 1.611 . . . . 0.0 108.258 -177.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.264 5.7 tp -118.55 -63.74 1.37 Allowed 'General case' 0 C--N 1.258 -3.378 0 CA-C-N 112.763 -2.017 . . . . 0.0 105.993 -177.554 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.444 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.0 pt-20 -53.74 -32.06 50.74 Favored 'General case' 0 C--N 1.283 -2.323 0 CA-C-O 123.029 1.395 . . . . 0.0 108.999 179.234 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.1 tp -72.26 -25.63 23.61 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.663 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.69 -177.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.3 t -114.96 -13.5 11.92 Favored 'General case' 0 C--N 1.267 -3.021 0 CA-C-N 114.074 -1.421 . . . . 0.0 112.513 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.7 OUTLIER -84.7 -31.14 24.25 Favored 'General case' 0 C--N 1.282 -2.357 0 N-CA-C 105.142 -2.17 . . . . 0.0 105.142 179.079 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? . . . . . 0 C--N 1.271 -2.836 0 CA-C-N 111.973 -2.376 . . . . 0.0 109.87 179.054 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 70.4 m . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . 0.562 ' C ' ' H ' ' A' ' 342' ' ' GLU . 4.8 m-20 51.01 -136.77 1.24 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.203 -0.936 . . . . 0.0 109.481 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' A' ' 342' ' ' GLU . 0.0 OUTLIER 74.26 -27.42 0.19 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.528 -0.732 . . . . 0.0 109.472 179.945 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . 0.562 ' H ' ' C ' ' A' ' 340' ' ' ASP . 0.0 OUTLIER -44.0 -82.94 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.756 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.47 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 1.6 p -93.79 6.56 6.61 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.47 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 6.7 t70 77.18 -179.04 0.13 Allowed 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.392 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -83.93 169.31 15.18 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-O 121.586 0.708 . . . . 0.0 109.619 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.45 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 4.9 t -123.8 -3.87 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -97.42 18.24 15.73 Favored 'General case' 0 C--N 1.28 -2.416 0 CA-C-O 123.003 1.382 . . . . 0.0 108.205 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -133.89 -11.08 2.66 Favored 'General case' 0 C--N 1.272 -2.795 0 N-CA-C 104.358 -2.46 . . . . 0.0 104.358 177.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -74.38 -34.1 63.24 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 113.96 -1.473 . . . . 0.0 107.591 178.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -67.7 -8.75 37.69 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 27.3 t -118.45 20.63 12.96 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 123.096 1.426 . . . . 0.0 107.198 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -125.11 8.66 7.98 Favored 'General case' 0 C--N 1.279 -2.496 0 CA-C-O 123.386 1.565 . . . . 0.0 108.146 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.525 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.288 0.1 OUTLIER -113.31 -60.19 1.92 Allowed 'General case' 0 C--N 1.258 -3.372 0 CA-C-N 112.785 -2.007 . . . . 0.0 105.953 -178.638 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.457 ' N ' HD22 ' A' ' 353' ' ' LEU . 23.4 pt-20 -54.15 -34.86 61.44 Favored 'General case' 0 C--N 1.276 -2.609 0 CA-C-N 114.026 -1.443 . . . . 0.0 109.253 -178.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . 0.433 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 6.3 tp -69.04 -26.8 33.1 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.591 0 CA-C-N 113.812 -1.54 . . . . 0.0 111.061 -177.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -112.93 -15.52 12.86 Favored 'General case' 0 C--N 1.265 -3.067 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.197 -176.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.2 OUTLIER -100.36 -6.96 24.98 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 179.493 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.426 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.284 -2.266 0 CA-C-N 113.314 -1.766 . . . . 0.0 110.012 179.237 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 44.8 m . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 53.18 -167.89 0.06 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.224 -0.922 . . . . 0.0 109.55 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . 0.483 ' CD ' ' N ' ' A' ' 341' ' ' LYS . 10.5 mptt -95.0 130.07 41.82 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 122.67 1.224 . . . . 0.0 110.681 -179.031 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.37 -63.01 0.52 Allowed 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 105.612 -1.995 . . . . 0.0 105.612 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.464 ' CG1' ' N ' ' A' ' 344' ' ' ASP . 9.2 p -106.29 -32.48 2.66 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 177.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.483 ' CG ' ' H ' ' A' ' 345' ' ' GLU . 21.1 t70 53.53 -162.31 0.11 Allowed 'General case' 0 C--N 1.273 -2.727 0 CA-C-N 114.091 -1.413 . . . . 0.0 110.948 178.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . 0.483 ' H ' ' CG ' ' A' ' 344' ' ' ASP . 29.1 mt-10 49.65 27.57 2.24 Favored 'General case' 0 C--N 1.3 -1.544 0 C-N-CA 119.842 -0.743 . . . . 0.0 110.35 179.119 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.443 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t -81.11 -3.49 6.69 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.828 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 178.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . 0.462 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 0.6 OUTLIER -95.39 13.49 25.64 Favored 'General case' 0 C--N 1.275 -2.672 0 CA-C-N 113.879 -1.509 . . . . 0.0 107.441 179.9 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -121.17 -11.81 8.78 Favored 'General case' 0 C--N 1.274 -2.691 0 N-CA-C 105.234 -2.136 . . . . 0.0 105.234 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.15 -25.92 55.76 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.424 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.462 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -80.28 -10.51 59.76 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 351' ' ' SER . . . . . 0.418 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 29.8 t -111.11 10.55 21.97 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.255 46.4 t0 -107.94 6.48 27.26 Favored 'General case' 0 C--N 1.281 -2.383 0 CA-C-O 123.875 1.797 . . . . 0.0 107.643 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.532 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.317 0.2 OUTLIER -105.95 -52.97 2.72 Favored 'General case' 0 C--N 1.258 -3.403 0 CA-C-N 112.011 -2.359 . . . . 0.0 106.891 -177.784 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.498 ' CG ' ' N ' ' A' ' 355' ' ' ILE . 18.6 pt-20 -51.3 -33.9 30.89 Favored 'General case' 0 C--N 1.283 -2.322 0 CA-C-N 113.661 -1.609 . . . . 0.0 108.556 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . 0.498 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.5 mt -70.31 -15.37 19.05 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.368 0 CA-C-N 113.5 -1.682 . . . . 0.0 110.111 -178.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.3 t -134.07 -4.74 2.74 Favored 'General case' 0 C--N 1.281 -2.374 0 C-N-CA 119.671 -0.811 . . . . 0.0 112.886 -174.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' A' ' 353' ' ' LEU . 10.4 tp -100.74 12.69 36.97 Favored 'General case' 0 C--N 1.284 -2.257 0 N-CA-C 104.783 -2.303 . . . . 0.0 104.783 177.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.446 ' OE1' ' N ' ' A' ' 358' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.286 -2.167 0 CA-C-N 112.954 -1.93 . . . . 0.0 109.567 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 71.7 m . . . . . 0 N--CA 1.488 1.473 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . 0.546 ' C ' ' H ' ' A' ' 342' ' ' GLU . 0.5 OUTLIER -55.92 -179.08 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.27 -0.894 . . . . 0.0 109.304 -179.932 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 72.68 -9.67 1.05 Allowed 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 122.367 1.079 . . . . 0.0 108.618 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . 0.546 ' H ' ' C ' ' A' ' 340' ' ' ASP . 0.1 OUTLIER -44.15 -83.16 0.01 OUTLIER 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.746 179.714 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . . . . . . . . . 6.6 p -101.85 44.78 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 CA-C-O 122.368 1.08 . . . . 0.0 109.775 -179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.456 ' OD1' ' N ' ' A' ' 345' ' ' GLU . 2.7 t70 -170.84 170.94 6.25 Favored 'General case' 0 C--N 1.276 -2.59 0 CA-C-O 122.251 1.024 . . . . 0.0 111.248 -178.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . 0.456 ' N ' ' OD1' ' A' ' 344' ' ' ASP . 19.9 mt-10 -144.39 159.63 42.4 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.238 -178.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.46 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t -129.55 -2.99 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -97.35 16.53 19.8 Favored 'General case' 0 C--N 1.281 -2.388 0 CA-C-O 122.592 1.187 . . . . 0.0 108.576 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -127.56 -10.26 5.65 Favored 'General case' 0 C--N 1.272 -2.769 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.94 -24.61 52.38 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 114.286 -1.325 . . . . 0.0 108.145 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -79.22 -11.13 59.96 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 39.5 t -111.93 8.7 20.42 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.267 13.5 t70 -106.86 11.27 30.21 Favored 'General case' 0 C--N 1.282 -2.366 0 CA-C-O 123.691 1.71 . . . . 0.0 107.798 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.48 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.307 0.0 OUTLIER -107.84 -58.91 1.91 Allowed 'General case' 0 C--N 1.257 -3.432 0 CA-C-N 112.112 -2.313 . . . . 0.0 106.3 -177.242 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.476 ' CG ' ' N ' ' A' ' 355' ' ' ILE . 16.1 pt-20 -47.93 -32.58 6.55 Favored 'General case' 0 C--N 1.281 -2.376 0 CA-C-N 113.223 -1.808 . . . . 0.0 108.978 -178.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . 0.476 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.3 mt -73.34 -17.49 17.75 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.319 0 CA-C-N 113.622 -1.626 . . . . 0.0 110.658 -178.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 356' ' ' THR . . . . . 0.452 ' N ' ' O ' ' A' ' 353' ' ' LEU . 2.1 t -130.51 -11.11 4.02 Favored 'General case' 0 C--N 1.28 -2.415 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -173.031 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.48 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.2 OUTLIER -95.16 14.48 21.96 Favored 'General case' 0 C--N 1.281 -2.39 0 N-CA-C 105.44 -2.059 . . . . 0.0 105.44 178.85 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.421 ' H ' ' C ' ' A' ' 356' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.285 -2.211 0 CA-C-N 113.135 -1.848 . . . . 0.0 109.617 -178.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 69.6 m . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 121.312 0.577 . . . . 0.0 109.547 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . 0.513 ' CG ' ' H ' ' A' ' 341' ' ' LYS . 22.4 t70 -167.15 -155.17 0.18 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.289 -0.882 . . . . 0.0 109.338 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . 0.513 ' H ' ' CG ' ' A' ' 340' ' ' ASP . 0.0 OUTLIER -124.6 -163.49 1.17 Allowed 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 -179.615 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 67.46 -62.94 0.31 Allowed 'General case' 0 C--N 1.304 -1.388 0 CA-C-O 122.17 0.986 . . . . 0.0 109.189 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.494 ' N ' ' O ' ' A' ' 341' ' ' LYS . 4.8 p -121.63 50.17 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.037 0 CA-C-O 122.757 1.265 . . . . 0.0 109.723 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.443 ' OD1' ' N ' ' A' ' 345' ' ' GLU . 14.5 t0 -170.45 172.72 5.91 Favored 'General case' 0 C--N 1.274 -2.7 0 CA-C-N 114.262 -1.335 . . . . 0.0 110.68 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . 0.443 ' N ' ' OD1' ' A' ' 344' ' ' ASP . 22.6 mt-10 48.48 20.92 0.34 Allowed 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 121.592 0.71 . . . . 0.0 109.89 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.413 ' N ' ' C ' ' A' ' 344' ' ' ASP . 3.7 t -83.94 -7.0 10.7 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 178.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . 0.462 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.0 t70 -96.68 13.85 26.95 Favored 'General case' 0 C--N 1.276 -2.618 0 CA-C-N 113.573 -1.648 . . . . 0.0 106.939 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -118.98 -13.72 9.42 Favored 'General case' 0 C--N 1.273 -2.726 0 N-CA-C 105.28 -2.118 . . . . 0.0 105.28 178.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -73.75 -35.21 65.0 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.554 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.462 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -69.36 -9.31 52.86 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.1 t -115.43 20.13 15.0 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -124.16 13.01 8.97 Favored 'General case' 0 C--N 1.28 -2.438 0 CA-C-O 123.39 1.567 . . . . 0.0 108.352 -177.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.577 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -118.53 -61.67 1.63 Allowed 'General case' 0 C--N 1.258 -3.391 0 CA-C-N 112.876 -1.966 . . . . 0.0 106.101 -177.412 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.448 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.1 pt-20 -56.18 -32.75 64.64 Favored 'General case' 0 C--N 1.282 -2.331 0 CA-C-O 122.952 1.358 . . . . 0.0 108.856 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . 0.4 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.0 tp -70.67 -28.04 32.97 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.693 0 CA-C-N 113.995 -1.457 . . . . 0.0 110.515 -177.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -112.51 -9.89 13.76 Favored 'General case' 0 C--N 1.265 -3.066 0 CA-C-N 113.743 -1.572 . . . . 0.0 111.404 -177.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.577 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.1 tp -107.82 -4.9 17.61 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.424 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.281 -2.377 0 CA-C-N 113.081 -1.872 . . . . 0.0 109.932 179.108 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 25.6 t . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 57.65 -140.98 0.78 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.281 -0.887 . . . . 0.0 109.814 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . 0.541 ' CD ' ' N ' ' A' ' 341' ' ' LYS . 10.3 mptt -86.4 120.25 27.54 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 123.104 1.431 . . . . 0.0 110.812 -178.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . 0.589 ' C ' ' H ' ' A' ' 344' ' ' ASP . 0.1 OUTLIER -124.22 -56.48 1.63 Allowed 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 106.191 -1.781 . . . . 0.0 106.191 179.9 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.41 ' CG2' ' O ' ' A' ' 343' ' ' VAL . 7.6 p -75.1 17.2 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-O 122.467 1.127 . . . . 0.0 109.097 178.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.589 ' H ' ' C ' ' A' ' 342' ' ' GLU . 5.1 t70 -160.41 -30.03 0.06 Allowed 'General case' 0 C--N 1.277 -2.571 0 C-N-CA 118.919 -1.112 . . . . 0.0 110.047 -178.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . 0.486 ' O ' ' O ' ' A' ' 344' ' ' ASP . 27.8 mt-10 53.7 150.56 0.0 OUTLIER 'General case' 0 C--N 1.276 -2.606 0 CA-C-O 122.243 1.02 . . . . 0.0 111.655 178.152 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.472 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 2.5 t -145.03 -0.14 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 CA-C-O 122.323 1.059 . . . . 0.0 108.678 179.528 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 4.4 t70 -91.09 15.34 11.86 Favored 'General case' 0 C--N 1.279 -2.459 0 CA-C-O 122.251 1.024 . . . . 0.0 109.071 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.93 -10.91 9.02 Favored 'General case' 0 C--N 1.272 -2.782 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.56 -33.53 58.5 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.585 -1.189 . . . . 0.0 108.189 178.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.424 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -70.75 -9.67 57.82 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 27.1 t -114.45 19.53 16.11 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -123.42 13.42 9.49 Favored 'General case' 0 C--N 1.28 -2.455 0 CA-C-N 113.816 -1.538 . . . . 0.0 108.39 -177.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.541 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.3 tp -119.4 -61.86 1.57 Allowed 'General case' 0 C--N 1.26 -3.299 0 CA-C-N 113.041 -1.89 . . . . 0.0 106.252 -177.235 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.458 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.2 pt-20 -56.27 -29.24 60.86 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 114.095 -1.412 . . . . 0.0 109.041 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.0 tp -76.49 -22.57 15.29 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.685 0 CA-C-N 113.768 -1.56 . . . . 0.0 110.69 -177.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 356' ' ' THR . . . . . 0.466 ' C ' ' H ' ' A' ' 358' ' ' GLU . 3.0 t -118.78 -11.86 9.73 Favored 'General case' 0 C--N 1.27 -2.879 0 CA-C-N 113.897 -1.501 . . . . 0.0 112.527 -176.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.541 ' N ' ' O ' ' A' ' 353' ' ' LEU . 7.7 tp -93.72 17.2 12.29 Favored 'General case' 0 C--N 1.286 -2.171 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 179.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.466 ' H ' ' C ' ' A' ' 356' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.283 -2.318 0 CA-C-N 113.123 -1.853 . . . . 0.0 109.667 -177.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 20.6 m . . . . . 0 N--CA 1.49 1.525 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -156.99 -36.16 0.08 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.22 -0.925 . . . . 0.0 109.548 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . 0.652 ' O ' ' N ' ' A' ' 343' ' ' VAL . 13.3 mttt 59.99 -129.29 1.04 Allowed 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.415 -0.803 . . . . 0.0 110.932 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 342' ' ' GLU . . . . . 0.454 ' C ' ' O ' ' A' ' 341' ' ' LYS . 0.0 OUTLIER 22.04 -76.58 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 122.045 0.926 . . . . 0.0 111.519 -179.84 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 343' ' ' VAL . . . . . 0.652 ' N ' ' O ' ' A' ' 341' ' ' LYS . 5.0 p -87.08 31.37 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.293 -1.87 0 CA-C-O 121.932 0.872 . . . . 0.0 110.29 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 344' ' ' ASP . . . . . 0.584 ' N ' ' O ' ' A' ' 341' ' ' LYS . 6.7 t70 -169.59 177.86 4.39 Favored 'General case' 0 C--N 1.283 -2.325 0 C-N-CA 118.769 -1.172 . . . . 0.0 110.981 -178.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 345' ' ' GLU . . . . . 0.484 ' N ' ' CG ' ' A' ' 344' ' ' ASP . 28.3 mt-10 58.82 147.32 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 121.85 0.833 . . . . 0.0 110.073 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 346' ' ' VAL . . . . . 0.456 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 9.1 t -151.87 -3.68 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 CA-C-O 121.962 0.887 . . . . 0.0 109.782 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 347' ' ' ASP . . . . . 0.446 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 4.8 t70 -92.26 14.88 15.02 Favored 'General case' 0 C--N 1.277 -2.573 0 CA-C-O 122.324 1.059 . . . . 0.0 108.767 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.12 -11.0 9.31 Favored 'General case' 0 C--N 1.272 -2.768 0 N-CA-C 105.438 -2.06 . . . . 0.0 105.438 178.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.27 -33.92 59.13 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 114.606 -1.179 . . . . 0.0 108.403 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 350' ' ' LEU . . . . . 0.446 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -70.16 -8.97 54.01 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 32.6 t -115.57 20.28 14.81 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -124.64 11.68 8.53 Favored 'General case' 0 C--N 1.279 -2.472 0 CA-C-O 123.359 1.552 . . . . 0.0 108.558 -177.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.7 tp -119.51 -62.08 1.54 Allowed 'General case' 0 C--N 1.258 -3.381 0 CA-C-N 113.033 -1.894 . . . . 0.0 106.141 -177.492 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 354' ' ' GLU . . . . . 0.447 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.3 pt-20 -56.11 -32.14 63.93 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 114.274 -1.33 . . . . 0.0 108.867 179.474 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 355' ' ' ILE . . . . . 0.401 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.6 tp -71.29 -27.71 30.05 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.691 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.506 -177.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.6 t -112.97 -9.54 13.59 Favored 'General case' 0 C--N 1.266 -3.053 0 CA-C-N 113.754 -1.566 . . . . 0.0 111.542 -177.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.5 tp -108.86 -3.77 17.37 Favored 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 105.701 -1.963 . . . . 0.0 105.701 179.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.33 0 CA-C-N 113.161 -1.836 . . . . 0.0 109.959 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 346' ' ' VAL . . . . . 0.477 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.6 t . . . . . 0 N--CA 1.494 1.759 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -93.72 16.68 13.4 Favored 'General case' 0 C--N 1.278 -2.535 0 CA-C-O 122.666 1.222 . . . . 0.0 108.751 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -130.08 -9.62 4.31 Favored 'General case' 0 C--N 1.273 -2.738 0 N-CA-C 104.847 -2.279 . . . . 0.0 104.847 177.591 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.94 -31.43 56.61 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 114.281 -1.327 . . . . 0.0 107.762 178.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.41 ' N ' HD23 ' A' ' 350' ' ' LEU . 1.6 pt? -70.57 -9.2 56.24 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.3 t -116.65 20.22 14.15 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -124.5 10.88 8.55 Favored 'General case' 0 C--N 1.281 -2.405 0 CA-C-O 123.26 1.505 . . . . 0.0 108.735 -177.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.573 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.5 tp -119.43 -62.2 1.53 Allowed 'General case' 0 C--N 1.259 -3.359 0 CA-C-N 113.098 -1.865 . . . . 0.0 106.046 -177.454 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.443 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 9.9 pt-20 -56.5 -32.35 64.97 Favored 'General case' 0 C--N 1.282 -2.333 0 CA-C-O 122.861 1.315 . . . . 0.0 108.815 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 355' ' ' ILE . . . . . 0.409 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.1 tp -70.81 -27.95 32.23 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.684 0 CA-C-N 114.135 -1.393 . . . . 0.0 110.384 -177.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.5 t -112.5 -9.72 13.77 Favored 'General case' 0 C--N 1.266 -3.036 0 CA-C-N 113.78 -1.555 . . . . 0.0 111.503 -177.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.573 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.7 tp . . . . . 0 C--N 1.29 -1.981 0 N-CA-C 105.765 -1.939 . . . . 0.0 105.765 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 346' ' ' VAL . . . . . 0.464 ' O ' HG12 ' A' ' 346' ' ' VAL . 13.8 t . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.926 0.869 . . . . 0.0 109.532 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 347' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.3 t0 -96.16 15.86 19.71 Favored 'General case' 0 C--N 1.278 -2.509 0 CA-C-O 122.532 1.158 . . . . 0.0 108.453 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -123.55 -12.9 7.65 Favored 'General case' 0 C--N 1.271 -2.829 0 N-CA-C 105.008 -2.219 . . . . 0.0 105.008 177.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -73.26 -27.19 61.43 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.307 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.424 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -78.35 -10.46 59.69 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 351' ' ' SER . . . . . 0.42 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 23.0 t -113.27 10.44 18.49 Favored 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.255 15.7 t70 -107.72 6.91 28.11 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-O 123.822 1.773 . . . . 0.0 107.689 -179.362 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.848 HD23 ' N ' ' A' ' 354' ' ' GLU 0.315 0.2 OUTLIER -106.24 -53.14 2.68 Favored 'General case' 0 C--N 1.257 -3.441 0 CA-C-N 112.061 -2.336 . . . . 0.0 106.849 -177.794 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.848 ' N ' HD23 ' A' ' 353' ' ' LEU . 18.8 pt-20 -51.17 -34.24 30.61 Favored 'General case' 0 C--N 1.283 -2.304 0 CA-C-N 113.598 -1.637 . . . . 0.0 108.676 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 355' ' ' ILE . . . . . 0.49 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -70.37 -15.3 18.96 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.374 0 CA-C-N 113.547 -1.66 . . . . 0.0 110.181 -178.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.4 t -134.22 -4.75 2.69 Favored 'General case' 0 C--N 1.282 -2.349 0 C-N-CA 119.59 -0.844 . . . . 0.0 112.883 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 353' ' ' LEU . 9.8 tp . . . . . 0 C--N 1.284 -2.24 0 N-CA-C 104.726 -2.324 . . . . 0.0 104.726 177.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 346' ' ' VAL . . . . . 0.494 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.7 t . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 122.476 1.131 . . . . 0.0 108.862 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 347' ' ' ASP . . . . . 0.445 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 5.6 t0 -90.46 14.38 13.18 Favored 'General case' 0 C--N 1.278 -2.503 0 CA-C-O 122.232 1.015 . . . . 0.0 108.925 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.7 -9.89 9.27 Favored 'General case' 0 C--N 1.274 -2.71 0 N-CA-C 105.53 -2.026 . . . . 0.0 105.53 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -77.2 -33.65 56.29 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 114.701 -1.136 . . . . 0.0 108.18 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.445 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -69.97 -9.24 54.45 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 28.6 t -115.2 20.26 15.06 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -124.84 11.54 8.39 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.237 1.494 . . . . 0.0 108.625 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.3 tp -119.56 -61.7 1.59 Allowed 'General case' 0 C--N 1.259 -3.366 0 CA-C-N 113.132 -1.849 . . . . 0.0 106.25 -177.463 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.444 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 14.0 pt-20 -56.52 -29.14 61.53 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-N 114.079 -1.419 . . . . 0.0 108.95 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.1 tp -75.59 -23.28 16.58 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.643 0 CA-C-N 113.881 -1.509 . . . . 0.0 110.551 -177.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.1 t -118.69 -11.15 9.88 Favored 'General case' 0 C--N 1.269 -2.907 0 CA-C-N 113.835 -1.529 . . . . 0.0 112.677 -176.413 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.54 ' N ' ' O ' ' A' ' 353' ' ' LEU . 7.9 tp . . . . . 0 C--N 1.286 -2.16 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 346' ' ' VAL . . . . . 0.47 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.6 t . . . . . 0 N--CA 1.496 1.845 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -95.71 17.69 14.51 Favored 'General case' 0 C--N 1.279 -2.476 0 CA-C-O 122.849 1.309 . . . . 0.0 108.55 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -131.84 -9.79 3.5 Favored 'General case' 0 C--N 1.272 -2.78 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 177.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -75.92 -33.27 59.88 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.124 -1.398 . . . . 0.0 107.6 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.423 ' N ' HD23 ' A' ' 350' ' ' LEU . 1.6 pt? -68.4 -9.23 46.9 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.6 t -117.36 20.67 13.52 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -125.43 11.33 8.02 Favored 'General case' 0 C--N 1.279 -2.458 0 CA-C-O 123.315 1.531 . . . . 0.0 108.521 -177.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.592 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.257 4.5 tp -118.75 -61.97 1.59 Allowed 'General case' 0 C--N 1.258 -3.383 0 CA-C-N 113.019 -1.901 . . . . 0.0 106.083 -177.561 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.44 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 18.5 pt-20 -55.96 -32.31 63.76 Favored 'General case' 0 C--N 1.283 -2.309 0 CA-C-O 122.942 1.353 . . . . 0.0 108.851 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 355' ' ' ILE . . . . . 0.421 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.87 -27.8 31.56 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.675 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.446 -177.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 356' ' ' THR . . . . . 0.405 ' H ' HG22 ' A' ' 356' ' ' THR . 3.4 t -113.05 -9.52 13.55 Favored 'General case' 0 C--N 1.267 -3.006 0 CA-C-N 113.721 -1.581 . . . . 0.0 111.503 -177.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.592 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.9 tp . . . . . 0 C--N 1.289 -2.025 0 N-CA-C 105.774 -1.935 . . . . 0.0 105.774 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 346' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 346' ' ' VAL . 5.4 t . . . . . 0 N--CA 1.494 1.737 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -95.32 17.78 13.76 Favored 'General case' 0 C--N 1.279 -2.495 0 CA-C-O 122.828 1.299 . . . . 0.0 108.525 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -134.16 -8.34 2.64 Favored 'General case' 0 C--N 1.272 -2.762 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 177.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -78.58 -33.47 47.61 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 114.044 -1.435 . . . . 0.0 107.461 178.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.439 ' N ' HD23 ' A' ' 350' ' ' LEU . 1.7 pt? -67.74 -8.84 38.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 29.2 t -116.76 21.18 13.56 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -128.56 9.02 5.95 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.34 1.543 . . . . 0.0 108.523 -177.324 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -118.85 -61.74 1.61 Allowed 'General case' 0 C--N 1.259 -3.347 0 CA-C-N 113.092 -1.867 . . . . 0.0 105.985 -177.634 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.438 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.0 pt-20 -56.55 -31.99 64.71 Favored 'General case' 0 C--N 1.283 -2.297 0 CA-C-O 122.889 1.328 . . . . 0.0 108.872 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 355' ' ' ILE . . . . . 0.41 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.3 tp -70.88 -27.48 30.44 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.642 0 CA-C-N 114.11 -1.405 . . . . 0.0 110.331 -178.071 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.5 t -113.63 -9.49 13.21 Favored 'General case' 0 C--N 1.268 -2.969 0 CA-C-N 113.777 -1.556 . . . . 0.0 111.755 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.9 tp . . . . . 0 C--N 1.288 -2.068 0 N-CA-C 105.677 -1.971 . . . . 0.0 105.677 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 346' ' ' VAL . . . . . 0.428 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t . . . . . 0 N--CA 1.487 1.417 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 347' ' ' ASP . . . . . 0.465 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 1.0 OUTLIER -94.67 12.74 26.64 Favored 'General case' 0 C--N 1.276 -2.614 0 CA-C-N 113.671 -1.604 . . . . 0.0 107.058 179.652 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -118.8 -11.43 9.78 Favored 'General case' 0 C--N 1.276 -2.627 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 178.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.98 -34.91 57.52 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.588 -1.187 . . . . 0.0 108.379 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.465 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -69.1 -9.75 54.21 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.0 t -113.44 19.67 16.73 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -126.15 12.65 7.72 Favored 'General case' 0 C--N 1.279 -2.465 0 CA-C-O 123.493 1.616 . . . . 0.0 108.067 -177.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.591 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.262 4.7 tp -117.99 -61.49 1.67 Allowed 'General case' 0 C--N 1.26 -3.307 0 CA-C-N 112.79 -2.005 . . . . 0.0 106.045 -177.569 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.433 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 12.2 pt-20 -55.76 -32.67 63.63 Favored 'General case' 0 C--N 1.283 -2.29 0 CA-C-O 122.943 1.354 . . . . 0.0 108.857 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 355' ' ' ILE . . . . . 0.425 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.74 -27.25 30.03 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.712 0 CA-C-N 113.967 -1.469 . . . . 0.0 110.436 -177.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -113.84 -9.06 13.13 Favored 'General case' 0 C--N 1.266 -3.035 0 CA-C-N 113.804 -1.543 . . . . 0.0 111.32 -177.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.591 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.7 tp . . . . . 0 C--N 1.288 -2.066 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 346' ' ' VAL . . . . . 0.469 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t . . . . . 0 N--CA 1.495 1.817 0 CA-C-O 122.784 1.278 . . . . 0.0 107.684 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 347' ' ' ASP . . . . . 0.451 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 2.3 t0 -88.25 14.35 9.58 Favored 'General case' 0 C--N 1.276 -2.605 0 CA-C-O 122.147 0.975 . . . . 0.0 109.076 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.69 -9.28 9.37 Favored 'General case' 0 C--N 1.274 -2.689 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 178.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -78.2 -31.64 49.55 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.121 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.451 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -72.27 -9.82 58.98 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 22.9 t -113.52 17.63 18.2 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -121.07 15.03 11.52 Favored 'General case' 0 C--N 1.279 -2.475 0 CA-C-O 123.585 1.66 . . . . 0.0 107.844 -177.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.598 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.268 4.6 tp -117.19 -61.08 1.76 Allowed 'General case' 0 C--N 1.259 -3.332 0 CA-C-N 112.553 -2.112 . . . . 0.0 106.023 -177.538 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 355' ' ' ILE . 10.1 pt-20 -55.43 -33.8 63.89 Favored 'General case' 0 C--N 1.283 -2.304 0 CA-C-O 122.965 1.364 . . . . 0.0 108.791 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 355' ' ' ILE . . . . . 0.431 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 3.8 tp -69.49 -27.18 33.11 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.667 0 CA-C-N 114.013 -1.449 . . . . 0.0 110.535 -178.156 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -114.22 -8.7 12.92 Favored 'General case' 0 C--N 1.266 -3.057 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.404 -177.123 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.598 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.4 tp . . . . . 0 C--N 1.289 -2.052 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 346' ' ' VAL . . . . . 0.466 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 4.4 t . . . . . 0 N--CA 1.494 1.747 0 CA-C-O 122.206 1.003 . . . . 0.0 108.568 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -94.76 17.42 13.58 Favored 'General case' 0 C--N 1.28 -2.438 0 CA-C-O 122.607 1.194 . . . . 0.0 108.789 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 348' ' ' ALA . . . . . 0.417 ' H ' ' H ' ' A' ' 349' ' ' ALA . . . -129.18 -10.8 4.71 Favored 'General case' 0 C--N 1.272 -2.802 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 177.417 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 349' ' ' ALA . . . . . 0.417 ' H ' ' H ' ' A' ' 348' ' ' ALA . . . -75.76 -25.42 56.47 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 114.299 -1.319 . . . . 0.0 108.068 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -77.63 -11.38 59.86 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 30.1 t -112.75 9.2 19.09 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.261 47.1 t0 -107.36 8.85 29.88 Favored 'General case' 0 C--N 1.281 -2.372 0 CA-C-O 123.829 1.776 . . . . 0.0 107.577 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.445 HD23 ' N ' ' A' ' 354' ' ' GLU 0.319 0.0 OUTLIER -106.22 -56.55 2.17 Favored 'General case' 0 C--N 1.257 -3.417 0 CA-C-N 111.93 -2.396 . . . . 0.0 106.377 -177.654 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.472 ' CG ' ' N ' ' A' ' 355' ' ' ILE . 17.9 pt-20 -49.79 -32.29 13.63 Favored 'General case' 0 C--N 1.278 -2.542 0 CA-C-N 113.145 -1.843 . . . . 0.0 108.823 -178.403 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 355' ' ' ILE . . . . . 0.472 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -72.93 -17.27 18.08 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.307 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.666 -178.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 1.8 t -128.88 -12.98 4.7 Favored 'General case' 0 C--N 1.282 -2.351 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -173.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 357' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.281 -2.385 0 N-CA-C 105.517 -2.031 . . . . 0.0 105.517 178.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 346' ' ' VAL . . . . . 0.473 ' O ' HG12 ' A' ' 346' ' ' VAL . 3.8 t . . . . . 0 N--CA 1.496 1.847 0 CA-C-O 122.402 1.096 . . . . 0.0 108.258 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 347' ' ' ASP . . . . . 0.407 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.1 t70 -93.77 14.55 18.94 Favored 'General case' 0 C--N 1.278 -2.502 0 CA-C-O 122.481 1.134 . . . . 0.0 108.619 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -123.92 -10.04 7.72 Favored 'General case' 0 C--N 1.273 -2.725 0 N-CA-C 105.091 -2.189 . . . . 0.0 105.091 177.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.35 -31.66 58.2 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.474 -1.239 . . . . 0.0 108.091 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.407 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.4 pt? -71.26 -9.74 58.61 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 31.0 t -114.96 19.27 15.93 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -123.75 13.29 9.26 Favored 'General case' 0 C--N 1.279 -2.459 0 CA-C-O 123.481 1.61 . . . . 0.0 108.07 -177.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.571 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.264 4.2 tp -117.38 -60.08 1.87 Allowed 'General case' 0 C--N 1.259 -3.332 0 CA-C-N 112.773 -2.012 . . . . 0.0 106.105 -177.378 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.429 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.1 pt-20 -57.17 -32.67 66.67 Favored 'General case' 0 C--N 1.282 -2.332 0 CA-C-O 123.052 1.406 . . . . 0.0 108.865 179.641 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 355' ' ' ILE . . . . . 0.423 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.99 -26.71 28.04 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.65 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.509 -177.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.3 t -113.26 -12.19 13.11 Favored 'General case' 0 C--N 1.266 -3.036 0 CA-C-N 113.826 -1.534 . . . . 0.0 111.461 -177.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.866 HD13 ' O ' ' A' ' 357' ' ' LEU . 2.6 tm? . . . . . 0 C--N 1.288 -2.066 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 346' ' ' VAL . . . . . 0.455 ' O ' HG12 ' A' ' 346' ' ' VAL . 5.4 t . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -99.54 16.2 24.08 Favored 'General case' 0 C--N 1.276 -2.594 0 CA-C-O 122.976 1.369 . . . . 0.0 107.789 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -128.46 -10.79 5.12 Favored 'General case' 0 C--N 1.272 -2.785 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 177.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -74.96 -32.63 61.75 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.319 -1.309 . . . . 0.0 107.99 178.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -70.21 -9.05 54.62 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.0 t -117.38 20.53 13.57 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -124.63 11.28 8.51 Favored 'General case' 0 C--N 1.28 -2.416 0 CA-C-O 123.376 1.56 . . . . 0.0 108.569 -177.468 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.578 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -119.45 -62.24 1.53 Allowed 'General case' 0 C--N 1.258 -3.39 0 CA-C-N 113.016 -1.902 . . . . 0.0 106.179 -177.372 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.44 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 11.2 pt-20 -55.99 -32.07 63.61 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-O 122.976 1.369 . . . . 0.0 108.894 179.338 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 355' ' ' ILE . . . . . 0.411 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.3 tp -70.98 -28.23 32.67 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.662 0 CA-C-N 113.999 -1.455 . . . . 0.0 110.375 -178.031 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 356' ' ' THR . . . . . 0.418 ' H ' HG22 ' A' ' 356' ' ' THR . 3.5 t -112.88 -9.36 13.65 Favored 'General case' 0 C--N 1.267 -3.003 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.764 -176.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.578 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.0 tp . . . . . 0 C--N 1.289 -2.027 0 N-CA-C 105.782 -1.933 . . . . 0.0 105.782 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 346' ' ' VAL . . . . . 0.46 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.2 t . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -94.6 17.07 13.95 Favored 'General case' 0 C--N 1.278 -2.5 0 CA-C-O 122.621 1.201 . . . . 0.0 108.456 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -128.54 -9.27 5.12 Favored 'General case' 0 C--N 1.272 -2.78 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 177.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -78.35 -22.72 47.58 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 114.294 -1.321 . . . . 0.0 108.049 178.567 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -80.52 -11.19 59.7 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 351' ' ' SER . . . . . 0.425 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 12.6 t -111.61 9.85 21.11 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.256 25.2 t0 -108.18 7.83 27.68 Favored 'General case' 0 C--N 1.281 -2.375 0 CA-C-O 123.891 1.805 . . . . 0.0 107.671 -179.335 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.907 HD23 ' N ' ' A' ' 354' ' ' GLU 0.318 0.5 OUTLIER -106.72 -53.41 2.62 Favored 'General case' 0 C--N 1.257 -3.43 0 CA-C-N 111.983 -2.372 . . . . 0.0 107.026 -177.676 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.907 ' N ' HD23 ' A' ' 353' ' ' LEU . 19.8 pt-20 -50.55 -34.76 26.75 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 113.563 -1.653 . . . . 0.0 108.635 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 355' ' ' ILE . . . . . 0.504 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -70.62 -14.87 18.48 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.338 0 CA-C-N 113.664 -1.607 . . . . 0.0 110.304 -178.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.3 t -133.97 -4.36 2.8 Favored 'General case' 0 C--N 1.28 -2.426 0 C-N-CA 119.586 -0.846 . . . . 0.0 112.583 -174.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.527 ' N ' ' O ' ' A' ' 353' ' ' LEU . 9.8 tp . . . . . 0 C--N 1.284 -2.258 0 N-CA-C 104.563 -2.384 . . . . 0.0 104.563 177.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 346' ' ' VAL . . . . . . . . . . . . . 41.4 t . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 122.092 0.949 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 347' ' ' ASP . . . . . 0.45 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.0 t0 -93.58 16.11 14.5 Favored 'General case' 0 C--N 1.272 -2.775 0 CA-C-O 122.659 1.218 . . . . 0.0 108.094 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -121.87 -14.87 7.99 Favored 'General case' 0 C--N 1.272 -2.785 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 178.009 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -70.66 -28.15 64.57 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.494 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.45 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -78.51 -10.36 59.68 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 351' ' ' SER . . . . . 0.42 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 43.5 t -113.5 10.77 18.24 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 179.526 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.254 34.8 t0 -107.82 7.57 28.27 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-O 123.902 1.811 . . . . 0.0 107.662 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.921 HD23 ' N ' ' A' ' 354' ' ' GLU 0.321 0.4 OUTLIER -106.41 -54.0 2.54 Favored 'General case' 0 C--N 1.256 -3.473 0 CA-C-N 111.988 -2.369 . . . . 0.0 107.03 -177.471 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.921 ' N ' HD23 ' A' ' 353' ' ' LEU . 17.2 pt-20 -50.53 -34.48 25.55 Favored 'General case' 0 C--N 1.282 -2.33 0 CA-C-N 113.911 -1.495 . . . . 0.0 108.712 179.468 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 355' ' ' ILE . . . . . 0.504 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.6 mt -69.31 -16.06 20.26 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.355 0 CA-C-N 113.623 -1.626 . . . . 0.0 110.128 -178.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 1.9 t -132.12 -5.87 3.46 Favored 'General case' 0 C--N 1.283 -2.322 0 C-N-CA 119.683 -0.807 . . . . 0.0 112.737 -174.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.506 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.286 -2.187 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 177.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 346' ' ' VAL . . . . . 0.471 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.6 t . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 122.422 1.106 . . . . 0.0 108.183 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -93.35 14.67 17.7 Favored 'General case' 0 C--N 1.278 -2.517 0 CA-C-O 122.505 1.145 . . . . 0.0 108.595 179.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -125.03 -10.15 7.13 Favored 'General case' 0 C--N 1.273 -2.739 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 177.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.2 -31.35 58.39 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.414 -1.266 . . . . 0.0 108.065 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -71.57 -9.77 58.74 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.9 t -115.28 19.14 15.77 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -122.88 13.44 9.87 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.483 1.611 . . . . 0.0 108.258 -177.632 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.264 5.7 tp -118.55 -63.74 1.37 Allowed 'General case' 0 C--N 1.258 -3.378 0 CA-C-N 112.763 -2.017 . . . . 0.0 105.993 -177.554 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.442 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.0 pt-20 -53.74 -32.06 50.74 Favored 'General case' 0 C--N 1.283 -2.323 0 CA-C-O 123.029 1.395 . . . . 0.0 108.999 179.234 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 355' ' ' ILE . . . . . 0.412 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.1 tp -72.26 -25.63 23.61 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.663 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.69 -177.709 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.3 t -114.96 -13.5 11.92 Favored 'General case' 0 C--N 1.267 -3.021 0 CA-C-N 114.074 -1.421 . . . . 0.0 112.513 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.282 -2.357 0 N-CA-C 105.142 -2.17 . . . . 0.0 105.142 179.079 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 346' ' ' VAL . . . . . 0.463 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.9 t . . . . . 0 N--CA 1.494 1.753 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -97.42 18.24 15.73 Favored 'General case' 0 C--N 1.28 -2.416 0 CA-C-O 123.003 1.382 . . . . 0.0 108.205 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 348' ' ' ALA . . . . . 0.432 ' H ' ' H ' ' A' ' 349' ' ' ALA . . . -133.89 -11.08 2.66 Favored 'General case' 0 C--N 1.272 -2.795 0 N-CA-C 104.358 -2.46 . . . . 0.0 104.358 177.424 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 349' ' ' ALA . . . . . 0.432 ' H ' ' H ' ' A' ' 348' ' ' ALA . . . -74.38 -34.1 63.24 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 113.96 -1.473 . . . . 0.0 107.591 178.314 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.445 ' N ' HD23 ' A' ' 350' ' ' LEU . 1.7 pt? -67.7 -8.75 37.69 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.577 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 27.3 t -118.45 20.63 12.96 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 123.096 1.426 . . . . 0.0 107.198 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -125.11 8.66 7.98 Favored 'General case' 0 C--N 1.279 -2.496 0 CA-C-O 123.386 1.565 . . . . 0.0 108.146 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.557 HD23 ' N ' ' A' ' 354' ' ' GLU 0.288 0.1 OUTLIER -113.31 -60.19 1.92 Allowed 'General case' 0 C--N 1.258 -3.372 0 CA-C-N 112.785 -2.007 . . . . 0.0 105.953 -178.638 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.557 ' N ' HD23 ' A' ' 353' ' ' LEU . 23.4 pt-20 -54.15 -34.86 61.44 Favored 'General case' 0 C--N 1.276 -2.609 0 CA-C-N 114.026 -1.443 . . . . 0.0 109.253 -178.35 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 355' ' ' ILE . . . . . 0.433 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 6.3 tp -69.04 -26.8 33.1 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.591 0 CA-C-N 113.812 -1.54 . . . . 0.0 111.061 -177.544 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 356' ' ' THR . . . . . 0.418 ' H ' HG22 ' A' ' 356' ' ' THR . 3.4 t -112.93 -15.52 12.86 Favored 'General case' 0 C--N 1.265 -3.067 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.197 -176.534 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.291 -1.967 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 346' ' ' VAL . . . . . 0.443 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t . . . . . 0 N--CA 1.488 1.439 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 347' ' ' ASP . . . . . 0.462 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 0.6 OUTLIER -95.39 13.49 25.64 Favored 'General case' 0 C--N 1.275 -2.672 0 CA-C-N 113.879 -1.509 . . . . 0.0 107.441 179.9 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -121.17 -11.81 8.78 Favored 'General case' 0 C--N 1.274 -2.691 0 N-CA-C 105.234 -2.136 . . . . 0.0 105.234 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.15 -25.92 55.76 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.424 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.462 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -80.28 -10.51 59.76 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 351' ' ' SER . . . . . 0.42 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 29.8 t -111.11 10.55 21.97 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.701 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.255 46.4 t0 -107.94 6.48 27.26 Favored 'General case' 0 C--N 1.281 -2.383 0 CA-C-O 123.875 1.797 . . . . 0.0 107.643 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.861 HD23 ' N ' ' A' ' 354' ' ' GLU 0.317 0.2 OUTLIER -105.95 -52.97 2.72 Favored 'General case' 0 C--N 1.258 -3.403 0 CA-C-N 112.011 -2.359 . . . . 0.0 106.891 -177.784 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.861 ' N ' HD23 ' A' ' 353' ' ' LEU . 18.6 pt-20 -51.3 -33.9 30.89 Favored 'General case' 0 C--N 1.283 -2.322 0 CA-C-N 113.661 -1.609 . . . . 0.0 108.556 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 355' ' ' ILE . . . . . 0.498 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.5 mt -70.31 -15.37 19.05 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.368 0 CA-C-N 113.5 -1.682 . . . . 0.0 110.111 -178.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.3 t -134.07 -4.74 2.74 Favored 'General case' 0 C--N 1.281 -2.374 0 C-N-CA 119.671 -0.811 . . . . 0.0 112.886 -174.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' A' ' 353' ' ' LEU . 10.4 tp . . . . . 0 C--N 1.284 -2.257 0 N-CA-C 104.783 -2.303 . . . . 0.0 104.783 177.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 346' ' ' VAL . . . . . 0.46 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t . . . . . 0 N--CA 1.496 1.868 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -97.35 16.53 19.8 Favored 'General case' 0 C--N 1.281 -2.388 0 CA-C-O 122.592 1.187 . . . . 0.0 108.576 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -127.56 -10.26 5.65 Favored 'General case' 0 C--N 1.272 -2.769 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.94 -24.61 52.38 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 114.286 -1.325 . . . . 0.0 108.145 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -79.22 -11.13 59.96 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 39.5 t -111.93 8.7 20.42 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.267 13.5 t70 -106.86 11.27 30.21 Favored 'General case' 0 C--N 1.282 -2.366 0 CA-C-O 123.691 1.71 . . . . 0.0 107.798 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.48 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.307 0.0 OUTLIER -107.84 -58.91 1.91 Allowed 'General case' 0 C--N 1.257 -3.432 0 CA-C-N 112.112 -2.313 . . . . 0.0 106.3 -177.242 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.476 ' CG ' ' N ' ' A' ' 355' ' ' ILE . 16.1 pt-20 -47.93 -32.58 6.55 Favored 'General case' 0 C--N 1.281 -2.376 0 CA-C-N 113.223 -1.808 . . . . 0.0 108.978 -178.951 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 355' ' ' ILE . . . . . 0.476 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.3 mt -73.34 -17.49 17.75 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.319 0 CA-C-N 113.622 -1.626 . . . . 0.0 110.658 -178.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.1 t -130.51 -11.11 4.02 Favored 'General case' 0 C--N 1.28 -2.415 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -173.031 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.48 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.281 -2.39 0 N-CA-C 105.44 -2.059 . . . . 0.0 105.44 178.85 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 346' ' ' VAL . . . . . . . . . . . . . 3.7 t . . . . . 0 N--CA 1.487 1.401 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 347' ' ' ASP . . . . . 0.462 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.0 t70 -96.68 13.85 26.95 Favored 'General case' 0 C--N 1.276 -2.618 0 CA-C-N 113.573 -1.648 . . . . 0.0 106.939 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -118.98 -13.72 9.42 Favored 'General case' 0 C--N 1.273 -2.726 0 N-CA-C 105.28 -2.118 . . . . 0.0 105.28 178.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -73.75 -35.21 65.0 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.554 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.462 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -69.36 -9.31 52.86 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.1 t -115.43 20.13 15.0 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -124.16 13.01 8.97 Favored 'General case' 0 C--N 1.28 -2.438 0 CA-C-O 123.39 1.567 . . . . 0.0 108.352 -177.568 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.577 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -118.53 -61.67 1.63 Allowed 'General case' 0 C--N 1.258 -3.391 0 CA-C-N 112.876 -1.966 . . . . 0.0 106.101 -177.412 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.445 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.1 pt-20 -56.18 -32.75 64.64 Favored 'General case' 0 C--N 1.282 -2.331 0 CA-C-O 122.952 1.358 . . . . 0.0 108.856 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 355' ' ' ILE . . . . . 0.415 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.0 tp -70.67 -28.04 32.97 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.693 0 CA-C-N 113.995 -1.457 . . . . 0.0 110.515 -177.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -112.51 -9.89 13.76 Favored 'General case' 0 C--N 1.265 -3.066 0 CA-C-N 113.743 -1.572 . . . . 0.0 111.404 -177.074 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.577 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.1 tp . . . . . 0 C--N 1.289 -2.055 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 346' ' ' VAL . . . . . 0.472 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 2.5 t . . . . . 0 N--CA 1.498 1.952 0 CA-C-O 122.323 1.059 . . . . 0.0 108.678 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 347' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 4.4 t70 -91.09 15.34 11.86 Favored 'General case' 0 C--N 1.279 -2.459 0 CA-C-O 122.251 1.024 . . . . 0.0 109.071 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.93 -10.91 9.02 Favored 'General case' 0 C--N 1.272 -2.782 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.56 -33.53 58.5 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.585 -1.189 . . . . 0.0 108.189 178.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.424 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -70.75 -9.67 57.82 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 27.1 t -114.45 19.53 16.11 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -123.42 13.42 9.49 Favored 'General case' 0 C--N 1.28 -2.455 0 CA-C-N 113.816 -1.538 . . . . 0.0 108.39 -177.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.541 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.3 tp -119.4 -61.86 1.57 Allowed 'General case' 0 C--N 1.26 -3.299 0 CA-C-N 113.041 -1.89 . . . . 0.0 106.252 -177.235 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.454 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.2 pt-20 -56.27 -29.24 60.86 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 114.095 -1.412 . . . . 0.0 109.041 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.0 tp -76.49 -22.57 15.29 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.685 0 CA-C-N 113.768 -1.56 . . . . 0.0 110.69 -177.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.0 t -118.78 -11.86 9.73 Favored 'General case' 0 C--N 1.27 -2.879 0 CA-C-N 113.897 -1.501 . . . . 0.0 112.527 -176.499 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.541 ' N ' ' O ' ' A' ' 353' ' ' LEU . 7.7 tp . . . . . 0 C--N 1.286 -2.171 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 346' ' ' VAL . . . . . 0.472 ' O ' HG12 ' A' ' 346' ' ' VAL . 9.1 t . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 121.962 0.887 . . . . 0.0 109.782 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 347' ' ' ASP . . . . . 0.446 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 4.8 t70 -92.26 14.88 15.02 Favored 'General case' 0 C--N 1.277 -2.573 0 CA-C-O 122.324 1.059 . . . . 0.0 108.767 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.12 -11.0 9.31 Favored 'General case' 0 C--N 1.272 -2.768 0 N-CA-C 105.438 -2.06 . . . . 0.0 105.438 178.26 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.27 -33.92 59.13 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 114.606 -1.179 . . . . 0.0 108.403 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 350' ' ' LEU . . . . . 0.446 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -70.16 -8.97 54.01 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 32.6 t -115.57 20.28 14.81 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -124.64 11.68 8.53 Favored 'General case' 0 C--N 1.279 -2.472 0 CA-C-O 123.359 1.552 . . . . 0.0 108.558 -177.287 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 353' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.7 tp -119.51 -62.08 1.54 Allowed 'General case' 0 C--N 1.258 -3.381 0 CA-C-N 113.033 -1.894 . . . . 0.0 106.141 -177.492 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 354' ' ' GLU . . . . . 0.44 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.3 pt-20 -56.11 -32.14 63.93 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 114.274 -1.33 . . . . 0.0 108.867 179.474 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 355' ' ' ILE . . . . . 0.415 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.6 tp -71.29 -27.71 30.05 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.691 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.506 -177.958 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 356' ' ' THR . . . . . 0.401 HG22 ' H ' ' A' ' 356' ' ' THR . 3.6 t -112.97 -9.54 13.59 Favored 'General case' 0 C--N 1.266 -3.053 0 CA-C-N 113.754 -1.566 . . . . 0.0 111.542 -177.004 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.5 tp . . . . . 0 C--N 1.289 -2.023 0 N-CA-C 105.701 -1.963 . . . . 0.0 105.701 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 22.0 t . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 18.4 p30 -162.21 172.84 15.11 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.237 -0.915 . . . . 0.0 109.622 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 341' ' ' LYS . . . . . 0.42 ' O ' ' C ' ' A' ' 342' ' ' GLU . 0.0 OUTLIER -167.77 -26.77 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.283 -0.885 . . . . 0.0 109.826 -179.912 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 342' ' ' GLU . . . . . 0.42 ' C ' ' O ' ' A' ' 341' ' ' LYS . 0.0 OUTLIER -40.94 -83.04 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.467 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 2.1 p -92.04 -0.54 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 178.189 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.467 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 6.3 t70 75.17 -174.8 0.13 Allowed 'General case' 0 C--N 1.287 -2.149 0 CA-C-O 122.261 1.029 . . . . 0.0 110.493 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -84.28 168.59 15.54 Favored 'General case' 0 C--N 1.29 -1.992 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.28 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.477 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.6 t -118.79 -2.14 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -93.72 16.68 13.4 Favored 'General case' 0 C--N 1.278 -2.535 0 CA-C-O 122.666 1.222 . . . . 0.0 108.751 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -130.08 -9.62 4.31 Favored 'General case' 0 C--N 1.273 -2.738 0 N-CA-C 104.847 -2.279 . . . . 0.0 104.847 177.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.94 -31.43 56.61 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 114.281 -1.327 . . . . 0.0 107.762 178.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.41 ' N ' HD23 ' A' ' 350' ' ' LEU . 1.6 pt? -70.57 -9.2 56.24 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.3 t -116.65 20.22 14.15 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -124.5 10.88 8.55 Favored 'General case' 0 C--N 1.281 -2.405 0 CA-C-O 123.26 1.505 . . . . 0.0 108.735 -177.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.573 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.5 tp -119.43 -62.2 1.53 Allowed 'General case' 0 C--N 1.259 -3.359 0 CA-C-N 113.098 -1.865 . . . . 0.0 106.046 -177.454 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.443 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 9.9 pt-20 -56.5 -32.35 64.97 Favored 'General case' 0 C--N 1.282 -2.333 0 CA-C-O 122.861 1.315 . . . . 0.0 108.815 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 355' ' ' ILE . . . . . 0.409 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.1 tp -70.81 -27.95 32.23 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.684 0 CA-C-N 114.135 -1.393 . . . . 0.0 110.384 -177.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.5 t -112.5 -9.72 13.77 Favored 'General case' 0 C--N 1.266 -3.036 0 CA-C-N 113.78 -1.555 . . . . 0.0 111.503 -177.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.573 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.7 tp -109.29 -3.71 16.98 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 105.765 -1.939 . . . . 0.0 105.765 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.431 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.282 -2.331 0 CA-C-N 113.097 -1.865 . . . . 0.0 110.041 179.11 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 65.5 m . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 340' ' ' ASP . . . . . 0.51 ' N ' ' OD1' ' A' ' 340' ' ' ASP . 0.5 OUTLIER -75.86 -177.2 3.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.198 -0.939 . . . . 0.0 109.402 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 341' ' ' LYS . . . . . 0.407 ' O ' ' C ' ' A' ' 342' ' ' GLU . 0.0 OUTLIER -168.85 -27.24 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.25 -0.906 . . . . 0.0 109.731 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 342' ' ' GLU . . . . . 0.454 ' C ' ' H ' ' A' ' 344' ' ' ASP . 0.2 OUTLIER -41.91 -82.62 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.359 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.532 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 3.6 p -83.93 13.59 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 178.217 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.532 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 3.7 t70 83.98 -173.93 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.39 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -114.7 159.59 20.35 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-O 121.841 0.829 . . . . 0.0 109.573 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.464 ' O ' HG12 ' A' ' 346' ' ' VAL . 13.8 t -149.36 -5.74 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.297 -1.709 0 CA-C-O 121.926 0.869 . . . . 0.0 109.532 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 347' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.3 t0 -96.16 15.86 19.71 Favored 'General case' 0 C--N 1.278 -2.509 0 CA-C-O 122.532 1.158 . . . . 0.0 108.453 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -123.55 -12.9 7.65 Favored 'General case' 0 C--N 1.271 -2.829 0 N-CA-C 105.008 -2.219 . . . . 0.0 105.008 177.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -73.26 -27.19 61.43 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.307 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.424 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -78.35 -10.46 59.69 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 351' ' ' SER . . . . . 0.42 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 23.0 t -113.27 10.44 18.49 Favored 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.255 15.7 t70 -107.72 6.91 28.11 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-O 123.822 1.773 . . . . 0.0 107.689 -179.362 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.848 HD23 ' N ' ' A' ' 354' ' ' GLU 0.315 0.2 OUTLIER -106.24 -53.14 2.68 Favored 'General case' 0 C--N 1.257 -3.441 0 CA-C-N 112.061 -2.336 . . . . 0.0 106.849 -177.794 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.848 ' N ' HD23 ' A' ' 353' ' ' LEU . 18.8 pt-20 -51.17 -34.24 30.61 Favored 'General case' 0 C--N 1.283 -2.304 0 CA-C-N 113.598 -1.637 . . . . 0.0 108.676 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 355' ' ' ILE . . . . . 0.49 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -70.37 -15.3 18.96 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.374 0 CA-C-N 113.547 -1.66 . . . . 0.0 110.181 -178.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.4 t -134.22 -4.75 2.69 Favored 'General case' 0 C--N 1.282 -2.349 0 C-N-CA 119.59 -0.844 . . . . 0.0 112.883 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 353' ' ' LEU . 9.8 tp -100.85 13.32 35.41 Favored 'General case' 0 C--N 1.284 -2.24 0 N-CA-C 104.726 -2.324 . . . . 0.0 104.726 177.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.401 ' HG3' ' H ' ' A' ' 358' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.286 -2.171 0 CA-C-N 113.006 -1.906 . . . . 0.0 109.515 -179.221 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 80.8 p . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 340' ' ' ASP . . . . . 0.506 ' C ' ' H ' ' A' ' 342' ' ' GLU . 61.5 m-20 -49.51 -88.84 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.242 -0.911 . . . . 0.0 109.425 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 341' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.08 -27.62 0.19 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.635 0.731 . . . . 0.0 109.861 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 342' ' ' GLU . . . . . 0.506 ' H ' ' C ' ' A' ' 340' ' ' ASP . 0.2 OUTLIER -47.32 -81.31 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 178.821 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.474 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 2.3 p -95.35 10.06 5.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.474 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 2.1 t70 79.01 -174.8 0.07 Allowed 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.07 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -116.61 160.88 20.03 Favored 'General case' 0 C--N 1.297 -1.694 0 CA-C-O 121.917 0.865 . . . . 0.0 109.801 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.494 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.7 t -147.67 0.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.695 0 CA-C-O 122.476 1.131 . . . . 0.0 108.862 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 347' ' ' ASP . . . . . 0.445 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 5.6 t0 -90.46 14.38 13.18 Favored 'General case' 0 C--N 1.278 -2.503 0 CA-C-O 122.232 1.015 . . . . 0.0 108.925 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.7 -9.89 9.27 Favored 'General case' 0 C--N 1.274 -2.71 0 N-CA-C 105.53 -2.026 . . . . 0.0 105.53 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -77.2 -33.65 56.29 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 114.701 -1.136 . . . . 0.0 108.18 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.445 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -69.97 -9.24 54.45 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 28.6 t -115.2 20.26 15.06 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -124.84 11.54 8.39 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.237 1.494 . . . . 0.0 108.625 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.3 tp -119.56 -61.7 1.59 Allowed 'General case' 0 C--N 1.259 -3.366 0 CA-C-N 113.132 -1.849 . . . . 0.0 106.25 -177.463 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.444 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 14.0 pt-20 -56.52 -29.14 61.53 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-N 114.079 -1.419 . . . . 0.0 108.95 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.1 tp -75.59 -23.28 16.58 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.643 0 CA-C-N 113.881 -1.509 . . . . 0.0 110.551 -177.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.1 t -118.69 -11.15 9.88 Favored 'General case' 0 C--N 1.269 -2.907 0 CA-C-N 113.835 -1.529 . . . . 0.0 112.677 -176.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.54 ' N ' ' O ' ' A' ' 353' ' ' LEU . 7.9 tp -97.93 17.55 17.96 Favored 'General case' 0 C--N 1.286 -2.16 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.283 -2.32 0 CA-C-N 113.19 -1.823 . . . . 0.0 109.752 -178.298 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 36.1 p . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -72.27 177.79 4.3 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.212 -0.93 . . . . 0.0 109.578 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 341' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.65 113.74 26.09 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-O 122.54 1.162 . . . . 0.0 110.102 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 342' ' ' GLU . . . . . 0.422 ' C ' ' H ' ' A' ' 344' ' ' ASP . 0.4 OUTLIER -104.5 -85.38 0.47 Allowed 'General case' 0 C--N 1.291 -1.964 0 N-CA-C 103.636 -2.727 . . . . 0.0 103.636 176.739 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.525 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 2.7 p -87.45 6.13 3.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 N-CA-C 104.296 -2.483 . . . . 0.0 104.296 173.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.525 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 6.4 t70 90.61 -178.55 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 113.502 -1.681 . . . . 0.0 110.336 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -107.82 163.91 12.71 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-O 121.542 0.687 . . . . 0.0 109.537 -179.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.47 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.6 t -130.03 -2.5 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -95.71 17.69 14.51 Favored 'General case' 0 C--N 1.279 -2.476 0 CA-C-O 122.849 1.309 . . . . 0.0 108.55 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -131.84 -9.79 3.5 Favored 'General case' 0 C--N 1.272 -2.78 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 177.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -75.92 -33.27 59.88 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.124 -1.398 . . . . 0.0 107.6 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.423 ' N ' HD23 ' A' ' 350' ' ' LEU . 1.6 pt? -68.4 -9.23 46.9 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.6 t -117.36 20.67 13.52 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -125.43 11.33 8.02 Favored 'General case' 0 C--N 1.279 -2.458 0 CA-C-O 123.315 1.531 . . . . 0.0 108.521 -177.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.592 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.257 4.5 tp -118.75 -61.97 1.59 Allowed 'General case' 0 C--N 1.258 -3.383 0 CA-C-N 113.019 -1.901 . . . . 0.0 106.083 -177.561 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.44 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 18.5 pt-20 -55.96 -32.31 63.76 Favored 'General case' 0 C--N 1.283 -2.309 0 CA-C-O 122.942 1.353 . . . . 0.0 108.851 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 355' ' ' ILE . . . . . 0.421 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.87 -27.8 31.56 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.675 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.446 -177.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 356' ' ' THR . . . . . 0.405 ' H ' HG22 ' A' ' 356' ' ' THR . 3.4 t -113.05 -9.52 13.55 Favored 'General case' 0 C--N 1.267 -3.006 0 CA-C-N 113.721 -1.581 . . . . 0.0 111.503 -177.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.592 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.9 tp -109.18 -3.97 16.89 Favored 'General case' 0 C--N 1.289 -2.025 0 N-CA-C 105.774 -1.935 . . . . 0.0 105.774 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.284 -2.276 0 CA-C-N 113.029 -1.896 . . . . 0.0 110.071 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 60.1 m . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 340' ' ' ASP . . . . . 0.48 ' C ' ' H ' ' A' ' 342' ' ' GLU . 4.8 m-20 -74.83 -141.6 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.257 -0.902 . . . . 0.0 109.273 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 341' ' ' LYS . . . . . 0.47 ' O ' ' C ' ' A' ' 342' ' ' GLU . 10.4 mttp 70.54 -43.94 0.56 Allowed 'General case' 0 N--CA 1.485 1.287 0 CA-C-O 121.575 0.702 . . . . 0.0 110.713 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 342' ' ' GLU . . . . . 0.48 ' H ' ' C ' ' A' ' 340' ' ' ASP . 0.0 OUTLIER -33.57 -80.55 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.379 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.233 179.862 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.44 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 2.3 p -95.64 -3.08 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 178.059 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.44 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 3.6 t70 71.99 -174.66 0.17 Allowed 'General case' 0 C--N 1.285 -2.233 0 CA-C-O 122.207 1.003 . . . . 0.0 110.47 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -102.25 166.92 10.31 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.18 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 346' ' ' VAL . 5.4 t -114.29 -4.73 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -95.32 17.78 13.76 Favored 'General case' 0 C--N 1.279 -2.495 0 CA-C-O 122.828 1.299 . . . . 0.0 108.525 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -134.16 -8.34 2.64 Favored 'General case' 0 C--N 1.272 -2.762 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 177.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -78.58 -33.47 47.61 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 114.044 -1.435 . . . . 0.0 107.461 178.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.439 ' N ' HD23 ' A' ' 350' ' ' LEU . 1.7 pt? -67.74 -8.84 38.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 29.2 t -116.76 21.18 13.56 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -128.56 9.02 5.95 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.34 1.543 . . . . 0.0 108.523 -177.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -118.85 -61.74 1.61 Allowed 'General case' 0 C--N 1.259 -3.347 0 CA-C-N 113.092 -1.867 . . . . 0.0 105.985 -177.634 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.438 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.0 pt-20 -56.55 -31.99 64.71 Favored 'General case' 0 C--N 1.283 -2.297 0 CA-C-O 122.889 1.328 . . . . 0.0 108.872 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 355' ' ' ILE . . . . . 0.41 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.3 tp -70.88 -27.48 30.44 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.642 0 CA-C-N 114.11 -1.405 . . . . 0.0 110.331 -178.071 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.5 t -113.63 -9.49 13.21 Favored 'General case' 0 C--N 1.268 -2.969 0 CA-C-N 113.777 -1.556 . . . . 0.0 111.755 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.9 tp -109.02 -3.74 17.2 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 105.677 -1.971 . . . . 0.0 105.677 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.404 ' O ' ' O ' ' A' ' 357' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.356 0 CA-C-N 113.114 -1.857 . . . . 0.0 110.037 179.22 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 54.2 p . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 340' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' A' ' 344' ' ' ASP . 0.9 OUTLIER -81.43 -1.19 44.8 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.224 -0.922 . . . . 0.0 109.441 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 341' ' ' LYS . . . . . 0.461 ' O ' ' C ' ' A' ' 342' ' ' GLU . 21.2 mttp -45.1 -44.29 10.33 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.895 0.855 . . . . 0.0 110.287 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 342' ' ' GLU . . . . . 0.461 ' C ' ' O ' ' A' ' 341' ' ' LYS . 0.4 OUTLIER -33.56 -79.65 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.252 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.494 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.427 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 3.8 p -87.72 -9.94 10.94 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.606 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.494 ' N ' ' O ' ' A' ' 340' ' ' ASP . 8.7 t70 69.95 -167.61 0.17 Allowed 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.486 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -131.3 22.55 4.8 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -179.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.428 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t -80.38 -4.07 6.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.783 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 178.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 347' ' ' ASP . . . . . 0.465 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 1.0 OUTLIER -94.67 12.74 26.64 Favored 'General case' 0 C--N 1.276 -2.614 0 CA-C-N 113.671 -1.604 . . . . 0.0 107.058 179.652 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -118.8 -11.43 9.78 Favored 'General case' 0 C--N 1.276 -2.627 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 178.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.98 -34.91 57.52 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.588 -1.187 . . . . 0.0 108.379 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.465 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -69.1 -9.75 54.21 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.0 t -113.44 19.67 16.73 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -126.15 12.65 7.72 Favored 'General case' 0 C--N 1.279 -2.465 0 CA-C-O 123.493 1.616 . . . . 0.0 108.067 -177.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.591 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.262 4.7 tp -117.99 -61.49 1.67 Allowed 'General case' 0 C--N 1.26 -3.307 0 CA-C-N 112.79 -2.005 . . . . 0.0 106.045 -177.569 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.433 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 12.2 pt-20 -55.76 -32.67 63.63 Favored 'General case' 0 C--N 1.283 -2.29 0 CA-C-O 122.943 1.354 . . . . 0.0 108.857 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 355' ' ' ILE . . . . . 0.425 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.74 -27.25 30.03 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.712 0 CA-C-N 113.967 -1.469 . . . . 0.0 110.436 -177.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -113.84 -9.06 13.13 Favored 'General case' 0 C--N 1.266 -3.035 0 CA-C-N 113.804 -1.543 . . . . 0.0 111.32 -177.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.591 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.7 tp -107.74 -4.89 17.71 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.405 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.281 -2.392 0 CA-C-N 113.008 -1.905 . . . . 0.0 109.901 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 26.7 t . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.331 0.586 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 340' ' ' ASP . . . . . 0.461 ' N ' ' OD1' ' A' ' 340' ' ' ASP . 21.7 p-10 -81.94 125.73 31.1 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.261 -0.899 . . . . 0.0 109.735 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 341' ' ' LYS . . . . . 0.544 ' O ' ' N ' ' A' ' 343' ' ' VAL . 0.0 OUTLIER 53.16 -166.77 0.07 Allowed 'General case' 0 C--N 1.304 -1.411 0 CA-C-O 121.526 0.679 . . . . 0.0 110.852 178.958 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 342' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 67.7 -65.51 0.24 Allowed 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 -178.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.544 ' N ' ' O ' ' A' ' 341' ' ' LYS . 0.3 OUTLIER -106.78 6.1 9.95 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.859 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 177.678 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.502 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 2.1 t70 79.49 -172.45 0.05 Allowed 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.771 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -107.15 166.95 10.24 Favored 'General case' 0 C--N 1.298 -1.65 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.654 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.469 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t -128.4 1.51 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 CA-C-O 122.784 1.278 . . . . 0.0 107.684 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 347' ' ' ASP . . . . . 0.451 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 2.3 t0 -88.25 14.35 9.58 Favored 'General case' 0 C--N 1.276 -2.605 0 CA-C-O 122.147 0.975 . . . . 0.0 109.076 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.69 -9.28 9.37 Favored 'General case' 0 C--N 1.274 -2.689 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 178.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -78.2 -31.64 49.55 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.121 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.451 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -72.27 -9.82 58.98 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 22.9 t -113.52 17.63 18.2 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -121.07 15.03 11.52 Favored 'General case' 0 C--N 1.279 -2.475 0 CA-C-O 123.585 1.66 . . . . 0.0 107.844 -177.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.598 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.268 4.6 tp -117.19 -61.08 1.76 Allowed 'General case' 0 C--N 1.259 -3.332 0 CA-C-N 112.553 -2.112 . . . . 0.0 106.023 -177.538 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 355' ' ' ILE . 10.1 pt-20 -55.43 -33.8 63.89 Favored 'General case' 0 C--N 1.283 -2.304 0 CA-C-O 122.965 1.364 . . . . 0.0 108.791 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 355' ' ' ILE . . . . . 0.431 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 3.8 tp -69.49 -27.18 33.11 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.667 0 CA-C-N 114.013 -1.449 . . . . 0.0 110.535 -178.156 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -114.22 -8.7 12.92 Favored 'General case' 0 C--N 1.266 -3.057 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.404 -177.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.598 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.4 tp -107.26 -5.99 17.52 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.425 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.365 0 CA-C-N 113.115 -1.857 . . . . 0.0 109.983 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 39.0 m . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 340' ' ' ASP . . . . . 0.491 ' C ' ' H ' ' A' ' 342' ' ' GLU . 36.5 m-20 -159.35 177.36 11.08 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.217 -0.927 . . . . 0.0 109.565 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 341' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.57 -18.6 0.47 Allowed 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 122.018 0.913 . . . . 0.0 108.862 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 342' ' ' GLU . . . . . 0.491 ' H ' ' C ' ' A' ' 340' ' ' ASP . 0.0 OUTLIER -44.83 -77.83 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 178.969 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.599 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 6.4 p -83.31 -3.09 7.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 N-CA-C 108.42 -0.955 . . . . 0.0 108.42 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.599 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 16.5 t70 127.88 167.9 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.914 0 O-C-N 124.967 1.417 . . . . 0.0 109.829 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 345' ' ' GLU . . . . . 0.483 ' N ' ' CG ' ' A' ' 344' ' ' ASP . 25.3 mt-10 -99.73 162.97 12.68 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.768 0.794 . . . . 0.0 109.32 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.466 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 4.4 t -139.37 -1.47 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 CA-C-O 122.206 1.003 . . . . 0.0 108.568 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -94.76 17.42 13.58 Favored 'General case' 0 C--N 1.28 -2.438 0 CA-C-O 122.607 1.194 . . . . 0.0 108.789 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 348' ' ' ALA . . . . . 0.417 ' H ' ' H ' ' A' ' 349' ' ' ALA . . . -129.18 -10.8 4.71 Favored 'General case' 0 C--N 1.272 -2.802 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 177.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 349' ' ' ALA . . . . . 0.417 ' H ' ' H ' ' A' ' 348' ' ' ALA . . . -75.76 -25.42 56.47 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 114.299 -1.319 . . . . 0.0 108.068 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -77.63 -11.38 59.86 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 30.1 t -112.75 9.2 19.09 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.261 47.1 t0 -107.36 8.85 29.88 Favored 'General case' 0 C--N 1.281 -2.372 0 CA-C-O 123.829 1.776 . . . . 0.0 107.577 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.445 HD23 ' N ' ' A' ' 354' ' ' GLU 0.319 0.0 OUTLIER -106.22 -56.55 2.17 Favored 'General case' 0 C--N 1.257 -3.417 0 CA-C-N 111.93 -2.396 . . . . 0.0 106.377 -177.654 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.472 ' CG ' ' N ' ' A' ' 355' ' ' ILE . 17.9 pt-20 -49.79 -32.29 13.63 Favored 'General case' 0 C--N 1.278 -2.542 0 CA-C-N 113.145 -1.843 . . . . 0.0 108.823 -178.403 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 355' ' ' ILE . . . . . 0.472 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -72.93 -17.27 18.08 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.307 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.666 -178.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 1.8 t -128.88 -12.98 4.7 Favored 'General case' 0 C--N 1.282 -2.351 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -173.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 357' ' ' LEU . 0.2 OUTLIER -95.59 15.71 19.15 Favored 'General case' 0 C--N 1.281 -2.385 0 N-CA-C 105.517 -2.031 . . . . 0.0 105.517 178.882 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.283 -2.287 0 CA-C-N 113.234 -1.803 . . . . 0.0 109.573 -178.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 42.6 m . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -159.4 -176.95 6.08 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.271 -0.893 . . . . 0.0 109.619 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 341' ' ' LYS . . . . . 0.535 ' O ' ' N ' ' A' ' 343' ' ' VAL . 1.9 mppt? -93.03 -162.3 0.92 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.469 -0.769 . . . . 0.0 109.1 -179.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 342' ' ' GLU . . . . . 0.502 ' C ' ' H ' ' A' ' 344' ' ' ASP . 1.5 mt-10 67.94 -64.52 0.28 Allowed 'General case' 0 C--N 1.308 -1.219 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.535 ' N ' ' O ' ' A' ' 341' ' ' LYS . 9.8 p -69.34 0.22 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.067 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.187 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.502 ' H ' ' C ' ' A' ' 342' ' ' GLU . 1.1 t70 179.97 174.01 0.92 Allowed 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.975 -179.063 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 345' ' ' GLU . . . . . 0.477 ' N ' ' CG ' ' A' ' 344' ' ' ASP . 31.9 mt-10 -142.6 159.9 41.34 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-O 121.572 0.701 . . . . 0.0 109.727 -179.018 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.473 ' O ' HG12 ' A' ' 346' ' ' VAL . 3.8 t -134.34 -0.65 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 CA-C-O 122.402 1.096 . . . . 0.0 108.258 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 347' ' ' ASP . . . . . 0.407 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.1 t70 -93.77 14.55 18.94 Favored 'General case' 0 C--N 1.278 -2.502 0 CA-C-O 122.481 1.134 . . . . 0.0 108.619 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -123.92 -10.04 7.72 Favored 'General case' 0 C--N 1.273 -2.725 0 N-CA-C 105.091 -2.189 . . . . 0.0 105.091 177.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.35 -31.66 58.2 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.474 -1.239 . . . . 0.0 108.091 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.407 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.4 pt? -71.26 -9.74 58.61 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 31.0 t -114.96 19.27 15.93 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -123.75 13.29 9.26 Favored 'General case' 0 C--N 1.279 -2.459 0 CA-C-O 123.481 1.61 . . . . 0.0 108.07 -177.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.571 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.264 4.2 tp -117.38 -60.08 1.87 Allowed 'General case' 0 C--N 1.259 -3.332 0 CA-C-N 112.773 -2.012 . . . . 0.0 106.105 -177.378 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.429 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.1 pt-20 -57.17 -32.67 66.67 Favored 'General case' 0 C--N 1.282 -2.332 0 CA-C-O 123.052 1.406 . . . . 0.0 108.865 179.641 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 355' ' ' ILE . . . . . 0.423 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.99 -26.71 28.04 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.65 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.509 -177.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.3 t -113.26 -12.19 13.11 Favored 'General case' 0 C--N 1.266 -3.036 0 CA-C-N 113.826 -1.534 . . . . 0.0 111.461 -177.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.866 HD13 ' O ' ' A' ' 357' ' ' LEU . 2.6 tm? -100.37 -9.98 21.68 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 179.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.436 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.285 -2.205 0 CA-C-N 113.06 -1.882 . . . . 0.0 110.136 179.227 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 43.9 t . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 340' ' ' ASP . . . . . 0.467 ' O ' ' N ' ' A' ' 342' ' ' GLU . 0.5 OUTLIER -173.66 -35.08 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.262 -0.899 . . . . 0.0 109.366 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 341' ' ' LYS . . . . . 0.453 ' O ' ' C ' ' A' ' 342' ' ' GLU . 0.0 OUTLIER -45.36 -21.85 0.11 Allowed 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.798 0.809 . . . . 0.0 109.419 179.517 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 342' ' ' GLU . . . . . 0.467 ' N ' ' O ' ' A' ' 340' ' ' ASP . 6.8 mm-40 -35.49 -77.28 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.185 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.537 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.432 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 0.3 OUTLIER -99.27 -0.36 10.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 178.324 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.432 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 1.7 t70 69.34 -173.43 0.18 Allowed 'General case' 0 C--N 1.284 -2.264 0 CA-C-O 122.158 0.98 . . . . 0.0 110.404 179.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -68.2 175.97 2.97 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.455 ' O ' HG12 ' A' ' 346' ' ' VAL . 5.4 t -109.76 -5.91 11.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 178.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -99.54 16.2 24.08 Favored 'General case' 0 C--N 1.276 -2.594 0 CA-C-O 122.976 1.369 . . . . 0.0 107.789 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -128.46 -10.79 5.12 Favored 'General case' 0 C--N 1.272 -2.785 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 177.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -74.96 -32.63 61.75 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.319 -1.309 . . . . 0.0 107.99 178.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -70.21 -9.05 54.62 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.0 t -117.38 20.53 13.57 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -124.63 11.28 8.51 Favored 'General case' 0 C--N 1.28 -2.416 0 CA-C-O 123.376 1.56 . . . . 0.0 108.569 -177.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.578 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -119.45 -62.24 1.53 Allowed 'General case' 0 C--N 1.258 -3.39 0 CA-C-N 113.016 -1.902 . . . . 0.0 106.179 -177.372 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.44 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 11.2 pt-20 -55.99 -32.07 63.61 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-O 122.976 1.369 . . . . 0.0 108.894 179.338 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 355' ' ' ILE . . . . . 0.411 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.3 tp -70.98 -28.23 32.67 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.662 0 CA-C-N 113.999 -1.455 . . . . 0.0 110.375 -178.031 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 356' ' ' THR . . . . . 0.418 ' H ' HG22 ' A' ' 356' ' ' THR . 3.5 t -112.88 -9.36 13.65 Favored 'General case' 0 C--N 1.267 -3.003 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.764 -176.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.578 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.0 tp -109.64 -3.34 16.91 Favored 'General case' 0 C--N 1.289 -2.027 0 N-CA-C 105.782 -1.933 . . . . 0.0 105.782 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.346 0 CA-C-N 113.093 -1.867 . . . . 0.0 110.032 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 339' ' ' SER . . . . . 0.418 ' O ' ' OD1' ' A' ' 340' ' ' ASP . 38.3 t . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 340' ' ' ASP . . . . . 0.418 ' OD1' ' O ' ' A' ' 339' ' ' SER . 74.5 m-20 -149.58 -30.03 0.24 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.288 -0.882 . . . . 0.0 109.323 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 341' ' ' LYS . . . . . 0.613 ' O ' ' N ' ' A' ' 343' ' ' VAL . 7.5 mttp 62.1 -126.98 0.73 Allowed 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.47 -0.769 . . . . 0.0 110.734 179.518 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 342' ' ' GLU . . . . . 0.477 ' C ' ' H ' ' A' ' 344' ' ' ASP . 0.8 OUTLIER 59.55 -68.69 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 122.422 1.106 . . . . 0.0 108.899 -179.851 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.613 ' N ' ' O ' ' A' ' 341' ' ' LYS . 6.2 p -71.23 5.47 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.112 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.27 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.483 ' CG ' ' N ' ' A' ' 345' ' ' GLU . 5.9 t70 -177.43 174.66 1.55 Allowed 'General case' 0 C--N 1.283 -2.29 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.409 -179.048 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 345' ' ' GLU . . . . . 0.483 ' N ' ' CG ' ' A' ' 344' ' ' ASP . 29.7 mt-10 -131.9 166.54 21.41 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.474 0.654 . . . . 0.0 109.857 -178.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.46 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.2 t -103.37 -1.12 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 178.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -94.6 17.07 13.95 Favored 'General case' 0 C--N 1.278 -2.5 0 CA-C-O 122.621 1.201 . . . . 0.0 108.456 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -128.54 -9.27 5.12 Favored 'General case' 0 C--N 1.272 -2.78 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 177.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -78.35 -22.72 47.58 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 114.294 -1.321 . . . . 0.0 108.049 178.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -80.52 -11.19 59.7 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 351' ' ' SER . . . . . 0.425 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 12.6 t -111.61 9.85 21.11 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.256 25.2 t0 -108.18 7.83 27.68 Favored 'General case' 0 C--N 1.281 -2.375 0 CA-C-O 123.891 1.805 . . . . 0.0 107.671 -179.335 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.907 HD23 ' N ' ' A' ' 354' ' ' GLU 0.318 0.5 OUTLIER -106.72 -53.41 2.62 Favored 'General case' 0 C--N 1.257 -3.43 0 CA-C-N 111.983 -2.372 . . . . 0.0 107.026 -177.676 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.907 ' N ' HD23 ' A' ' 353' ' ' LEU . 19.8 pt-20 -50.55 -34.76 26.75 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 113.563 -1.653 . . . . 0.0 108.635 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 355' ' ' ILE . . . . . 0.504 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -70.62 -14.87 18.48 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.338 0 CA-C-N 113.664 -1.607 . . . . 0.0 110.304 -178.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.3 t -133.97 -4.36 2.8 Favored 'General case' 0 C--N 1.28 -2.426 0 C-N-CA 119.586 -0.846 . . . . 0.0 112.583 -174.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.527 ' N ' ' O ' ' A' ' 353' ' ' LEU . 9.8 tp -94.58 11.4 31.16 Favored 'General case' 0 C--N 1.284 -2.258 0 N-CA-C 104.563 -2.384 . . . . 0.0 104.563 177.485 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.449 ' OE1' ' N ' ' A' ' 358' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.286 -2.165 0 CA-C-N 112.96 -1.927 . . . . 0.0 109.698 -178.631 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 340' ' ' ASP . . . . . 0.506 ' CG ' ' H ' ' A' ' 341' ' ' LYS . 20.5 t0 -92.92 -166.13 1.47 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.22 -0.925 . . . . 0.0 109.762 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 341' ' ' LYS . . . . . 0.588 ' O ' ' N ' ' A' ' 343' ' ' VAL . 9.5 mptt -91.18 -151.4 0.26 Allowed 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.588 -0.695 . . . . 0.0 109.534 -179.185 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 342' ' ' GLU . . . . . 0.512 ' C ' ' H ' ' A' ' 344' ' ' ASP . 19.8 mm-40 63.32 -71.39 0.06 Allowed 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 -179.084 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.588 ' N ' ' O ' ' A' ' 341' ' ' LYS . 8.4 p -61.01 -5.96 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.023 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 177.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.512 ' H ' ' C ' ' A' ' 342' ' ' GLU . 7.0 t70 -179.63 169.57 1.34 Allowed 'General case' 0 C--N 1.288 -2.087 0 CA-C-O 121.916 0.865 . . . . 0.0 110.165 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 345' ' ' GLU . . . . . 0.49 ' O ' HG23 ' A' ' 346' ' ' VAL . 38.1 mt-10 -146.11 157.42 43.84 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.623 0.725 . . . . 0.0 109.558 -179.158 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 345' ' ' GLU . 41.4 t -156.09 -18.31 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 CA-C-O 122.092 0.949 . . . . 0.0 109.512 179.121 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 347' ' ' ASP . . . . . 0.45 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.0 t0 -93.58 16.11 14.5 Favored 'General case' 0 C--N 1.272 -2.775 0 CA-C-O 122.659 1.218 . . . . 0.0 108.094 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -121.87 -14.87 7.99 Favored 'General case' 0 C--N 1.272 -2.785 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 178.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -70.66 -28.15 64.57 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.494 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.45 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -78.51 -10.36 59.68 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 351' ' ' SER . . . . . 0.42 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 43.5 t -113.5 10.77 18.24 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 179.526 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.254 34.8 t0 -107.82 7.57 28.27 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-O 123.902 1.811 . . . . 0.0 107.662 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.921 HD23 ' N ' ' A' ' 354' ' ' GLU 0.321 0.4 OUTLIER -106.41 -54.0 2.54 Favored 'General case' 0 C--N 1.256 -3.473 0 CA-C-N 111.988 -2.369 . . . . 0.0 107.03 -177.471 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.921 ' N ' HD23 ' A' ' 353' ' ' LEU . 17.2 pt-20 -50.53 -34.48 25.55 Favored 'General case' 0 C--N 1.282 -2.33 0 CA-C-N 113.911 -1.495 . . . . 0.0 108.712 179.468 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 355' ' ' ILE . . . . . 0.504 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.6 mt -69.31 -16.06 20.26 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.355 0 CA-C-N 113.623 -1.626 . . . . 0.0 110.128 -178.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 1.9 t -132.12 -5.87 3.46 Favored 'General case' 0 C--N 1.283 -2.322 0 C-N-CA 119.683 -0.807 . . . . 0.0 112.737 -174.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.506 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.9 OUTLIER -97.91 10.55 39.97 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 177.911 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.276 -2.609 0 CA-C-N 112.671 -2.059 . . . . 0.0 109.545 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 38.4 m . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -163.74 -178.55 5.81 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.229 -0.919 . . . . 0.0 109.633 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 341' ' ' LYS . . . . . 0.541 ' CD ' ' N ' ' A' ' 341' ' ' LYS . 9.9 mptt -92.27 -161.86 0.87 Allowed 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.496 -0.753 . . . . 0.0 109.993 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 342' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 66.13 -66.38 0.17 Allowed 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 122.288 1.042 . . . . 0.0 108.773 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.534 ' N ' ' O ' ' A' ' 341' ' ' LYS . 6.4 p -86.53 -40.47 14.23 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.943 0 CA-C-O 122.243 1.021 . . . . 0.0 109.169 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.534 ' N ' ' CG1' ' A' ' 343' ' ' VAL . 15.0 t0 59.12 -174.58 0.1 Allowed 'General case' 0 C--N 1.27 -2.89 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.988 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -123.08 162.64 22.04 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-O 121.657 0.741 . . . . 0.0 109.588 -179.116 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.471 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.6 t -132.11 -0.7 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 CA-C-O 122.422 1.106 . . . . 0.0 108.183 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -93.35 14.67 17.7 Favored 'General case' 0 C--N 1.278 -2.517 0 CA-C-O 122.505 1.145 . . . . 0.0 108.595 179.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -125.03 -10.15 7.13 Favored 'General case' 0 C--N 1.273 -2.739 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 177.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.2 -31.35 58.39 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.414 -1.266 . . . . 0.0 108.065 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -71.57 -9.77 58.74 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.9 t -115.28 19.14 15.77 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -122.88 13.44 9.87 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.483 1.611 . . . . 0.0 108.258 -177.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.264 5.7 tp -118.55 -63.74 1.37 Allowed 'General case' 0 C--N 1.258 -3.378 0 CA-C-N 112.763 -2.017 . . . . 0.0 105.993 -177.554 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.442 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.0 pt-20 -53.74 -32.06 50.74 Favored 'General case' 0 C--N 1.283 -2.323 0 CA-C-O 123.029 1.395 . . . . 0.0 108.999 179.234 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 355' ' ' ILE . . . . . 0.412 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.1 tp -72.26 -25.63 23.61 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.663 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.69 -177.709 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.3 t -114.96 -13.5 11.92 Favored 'General case' 0 C--N 1.267 -3.021 0 CA-C-N 114.074 -1.421 . . . . 0.0 112.513 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.7 OUTLIER -84.7 -31.14 24.25 Favored 'General case' 0 C--N 1.282 -2.357 0 N-CA-C 105.142 -2.17 . . . . 0.0 105.142 179.079 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? . . . . . 0 C--N 1.271 -2.836 0 CA-C-N 111.973 -2.376 . . . . 0.0 109.87 179.054 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 70.4 m . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 340' ' ' ASP . . . . . 0.525 ' C ' ' H ' ' A' ' 342' ' ' GLU . 4.8 m-20 51.01 -136.77 1.24 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.203 -0.936 . . . . 0.0 109.481 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 341' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' A' ' 342' ' ' GLU . 0.0 OUTLIER 74.26 -27.42 0.19 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.528 -0.732 . . . . 0.0 109.472 179.945 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 342' ' ' GLU . . . . . 0.525 ' H ' ' C ' ' A' ' 340' ' ' ASP . 0.0 OUTLIER -44.0 -82.94 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.756 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.47 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 1.6 p -93.79 6.56 6.61 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.47 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 6.7 t70 77.18 -179.04 0.13 Allowed 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.392 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -83.93 169.31 15.18 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-O 121.586 0.708 . . . . 0.0 109.619 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.463 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.9 t -123.8 -3.87 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -97.42 18.24 15.73 Favored 'General case' 0 C--N 1.28 -2.416 0 CA-C-O 123.003 1.382 . . . . 0.0 108.205 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 348' ' ' ALA . . . . . 0.432 ' H ' ' H ' ' A' ' 349' ' ' ALA . . . -133.89 -11.08 2.66 Favored 'General case' 0 C--N 1.272 -2.795 0 N-CA-C 104.358 -2.46 . . . . 0.0 104.358 177.424 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 349' ' ' ALA . . . . . 0.432 ' H ' ' H ' ' A' ' 348' ' ' ALA . . . -74.38 -34.1 63.24 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 113.96 -1.473 . . . . 0.0 107.591 178.314 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.445 ' N ' HD23 ' A' ' 350' ' ' LEU . 1.7 pt? -67.7 -8.75 37.69 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.577 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 27.3 t -118.45 20.63 12.96 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 123.096 1.426 . . . . 0.0 107.198 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -125.11 8.66 7.98 Favored 'General case' 0 C--N 1.279 -2.496 0 CA-C-O 123.386 1.565 . . . . 0.0 108.146 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.557 HD23 ' N ' ' A' ' 354' ' ' GLU 0.288 0.1 OUTLIER -113.31 -60.19 1.92 Allowed 'General case' 0 C--N 1.258 -3.372 0 CA-C-N 112.785 -2.007 . . . . 0.0 105.953 -178.638 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.557 ' N ' HD23 ' A' ' 353' ' ' LEU . 23.4 pt-20 -54.15 -34.86 61.44 Favored 'General case' 0 C--N 1.276 -2.609 0 CA-C-N 114.026 -1.443 . . . . 0.0 109.253 -178.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 355' ' ' ILE . . . . . 0.433 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 6.3 tp -69.04 -26.8 33.1 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.591 0 CA-C-N 113.812 -1.54 . . . . 0.0 111.061 -177.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 356' ' ' THR . . . . . 0.418 ' H ' HG22 ' A' ' 356' ' ' THR . 3.4 t -112.93 -15.52 12.86 Favored 'General case' 0 C--N 1.265 -3.067 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.197 -176.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.2 OUTLIER -100.36 -6.96 24.98 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 179.493 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.426 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.284 -2.266 0 CA-C-N 113.314 -1.766 . . . . 0.0 110.012 179.237 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 44.8 m . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 53.18 -167.89 0.06 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.224 -0.922 . . . . 0.0 109.55 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 341' ' ' LYS . . . . . 0.483 ' CD ' ' N ' ' A' ' 341' ' ' LYS . 10.5 mptt -95.0 130.07 41.82 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 122.67 1.224 . . . . 0.0 110.681 -179.031 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 342' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.37 -63.01 0.52 Allowed 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 105.612 -1.995 . . . . 0.0 105.612 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.464 ' CG1' ' N ' ' A' ' 344' ' ' ASP . 9.2 p -106.29 -32.48 2.66 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 177.535 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.464 ' N ' ' CG1' ' A' ' 343' ' ' VAL . 21.1 t70 53.53 -162.31 0.11 Allowed 'General case' 0 C--N 1.273 -2.727 0 CA-C-N 114.091 -1.413 . . . . 0.0 110.948 178.617 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 345' ' ' GLU . . . . . 0.438 ' H ' ' CG ' ' A' ' 344' ' ' ASP . 29.1 mt-10 49.65 27.57 2.24 Favored 'General case' 0 C--N 1.3 -1.544 0 C-N-CA 119.842 -0.743 . . . . 0.0 110.35 179.119 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.443 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t -81.11 -3.49 6.69 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.828 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 178.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 347' ' ' ASP . . . . . 0.462 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 0.6 OUTLIER -95.39 13.49 25.64 Favored 'General case' 0 C--N 1.275 -2.672 0 CA-C-N 113.879 -1.509 . . . . 0.0 107.441 179.9 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -121.17 -11.81 8.78 Favored 'General case' 0 C--N 1.274 -2.691 0 N-CA-C 105.234 -2.136 . . . . 0.0 105.234 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.15 -25.92 55.76 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.424 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.462 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -80.28 -10.51 59.76 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 351' ' ' SER . . . . . 0.42 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 29.8 t -111.11 10.55 21.97 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.701 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.255 46.4 t0 -107.94 6.48 27.26 Favored 'General case' 0 C--N 1.281 -2.383 0 CA-C-O 123.875 1.797 . . . . 0.0 107.643 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.861 HD23 ' N ' ' A' ' 354' ' ' GLU 0.317 0.2 OUTLIER -105.95 -52.97 2.72 Favored 'General case' 0 C--N 1.258 -3.403 0 CA-C-N 112.011 -2.359 . . . . 0.0 106.891 -177.784 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.861 ' N ' HD23 ' A' ' 353' ' ' LEU . 18.6 pt-20 -51.3 -33.9 30.89 Favored 'General case' 0 C--N 1.283 -2.322 0 CA-C-N 113.661 -1.609 . . . . 0.0 108.556 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 355' ' ' ILE . . . . . 0.498 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.5 mt -70.31 -15.37 19.05 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.368 0 CA-C-N 113.5 -1.682 . . . . 0.0 110.111 -178.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.3 t -134.07 -4.74 2.74 Favored 'General case' 0 C--N 1.281 -2.374 0 C-N-CA 119.671 -0.811 . . . . 0.0 112.886 -174.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' A' ' 353' ' ' LEU . 10.4 tp -100.74 12.69 36.97 Favored 'General case' 0 C--N 1.284 -2.257 0 N-CA-C 104.783 -2.303 . . . . 0.0 104.783 177.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.446 ' OE1' ' N ' ' A' ' 358' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.286 -2.167 0 CA-C-N 112.954 -1.93 . . . . 0.0 109.567 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 71.7 m . . . . . 0 N--CA 1.488 1.473 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 340' ' ' ASP . . . . . 0.531 ' N ' ' OD1' ' A' ' 340' ' ' ASP . 0.5 OUTLIER -55.92 -179.08 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.27 -0.894 . . . . 0.0 109.304 -179.932 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 341' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 72.68 -9.67 1.05 Allowed 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 122.367 1.079 . . . . 0.0 108.618 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 342' ' ' GLU . . . . . 0.511 ' H ' ' C ' ' A' ' 340' ' ' ASP . 0.1 OUTLIER -44.15 -83.16 0.01 OUTLIER 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.746 179.714 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.646 HG13 ' O ' ' A' ' 343' ' ' VAL . 6.6 p -101.85 44.78 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 CA-C-O 122.368 1.08 . . . . 0.0 109.775 -179.61 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.456 ' OD1' ' N ' ' A' ' 345' ' ' GLU . 2.7 t70 -170.84 170.94 6.25 Favored 'General case' 0 C--N 1.276 -2.59 0 CA-C-O 122.251 1.024 . . . . 0.0 111.248 -178.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 345' ' ' GLU . . . . . 0.456 ' N ' ' OD1' ' A' ' 344' ' ' ASP . 19.9 mt-10 -144.39 159.63 42.4 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.238 -178.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.46 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t -129.55 -2.99 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -97.35 16.53 19.8 Favored 'General case' 0 C--N 1.281 -2.388 0 CA-C-O 122.592 1.187 . . . . 0.0 108.576 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -127.56 -10.26 5.65 Favored 'General case' 0 C--N 1.272 -2.769 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.94 -24.61 52.38 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 114.286 -1.325 . . . . 0.0 108.145 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -79.22 -11.13 59.96 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 39.5 t -111.93 8.7 20.42 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.267 13.5 t70 -106.86 11.27 30.21 Favored 'General case' 0 C--N 1.282 -2.366 0 CA-C-O 123.691 1.71 . . . . 0.0 107.798 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.48 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.307 0.0 OUTLIER -107.84 -58.91 1.91 Allowed 'General case' 0 C--N 1.257 -3.432 0 CA-C-N 112.112 -2.313 . . . . 0.0 106.3 -177.242 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.476 ' CG ' ' N ' ' A' ' 355' ' ' ILE . 16.1 pt-20 -47.93 -32.58 6.55 Favored 'General case' 0 C--N 1.281 -2.376 0 CA-C-N 113.223 -1.808 . . . . 0.0 108.978 -178.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 355' ' ' ILE . . . . . 0.476 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.3 mt -73.34 -17.49 17.75 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.319 0 CA-C-N 113.622 -1.626 . . . . 0.0 110.658 -178.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.1 t -130.51 -11.11 4.02 Favored 'General case' 0 C--N 1.28 -2.415 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -173.031 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.48 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.2 OUTLIER -95.16 14.48 21.96 Favored 'General case' 0 C--N 1.281 -2.39 0 N-CA-C 105.44 -2.059 . . . . 0.0 105.44 178.85 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.285 -2.211 0 CA-C-N 113.135 -1.848 . . . . 0.0 109.617 -178.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 69.6 m . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 121.312 0.577 . . . . 0.0 109.547 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 340' ' ' ASP . . . . . 0.495 ' CG ' ' H ' ' A' ' 341' ' ' LYS . 22.4 t70 -167.15 -155.17 0.18 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.289 -0.882 . . . . 0.0 109.338 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 341' ' ' LYS . . . . . 0.495 ' H ' ' CG ' ' A' ' 340' ' ' ASP . 0.0 OUTLIER -124.6 -163.49 1.17 Allowed 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 -179.615 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 342' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 67.46 -62.94 0.31 Allowed 'General case' 0 C--N 1.304 -1.388 0 CA-C-O 122.17 0.986 . . . . 0.0 109.189 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.669 ' O ' HG22 ' A' ' 343' ' ' VAL . 4.8 p -121.63 50.17 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.037 0 CA-C-O 122.757 1.265 . . . . 0.0 109.723 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.443 ' OD1' ' N ' ' A' ' 345' ' ' GLU . 14.5 t0 -170.45 172.72 5.91 Favored 'General case' 0 C--N 1.274 -2.7 0 CA-C-N 114.262 -1.335 . . . . 0.0 110.68 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 345' ' ' GLU . . . . . 0.443 ' N ' ' OD1' ' A' ' 344' ' ' ASP . 22.6 mt-10 48.48 20.92 0.34 Allowed 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 121.592 0.71 . . . . 0.0 109.89 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.413 ' N ' ' C ' ' A' ' 344' ' ' ASP . 3.7 t -83.94 -7.0 10.7 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 178.695 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 347' ' ' ASP . . . . . 0.462 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.0 t70 -96.68 13.85 26.95 Favored 'General case' 0 C--N 1.276 -2.618 0 CA-C-N 113.573 -1.648 . . . . 0.0 106.939 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -118.98 -13.72 9.42 Favored 'General case' 0 C--N 1.273 -2.726 0 N-CA-C 105.28 -2.118 . . . . 0.0 105.28 178.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -73.75 -35.21 65.0 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.554 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.462 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -69.36 -9.31 52.86 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.1 t -115.43 20.13 15.0 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -124.16 13.01 8.97 Favored 'General case' 0 C--N 1.28 -2.438 0 CA-C-O 123.39 1.567 . . . . 0.0 108.352 -177.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.577 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -118.53 -61.67 1.63 Allowed 'General case' 0 C--N 1.258 -3.391 0 CA-C-N 112.876 -1.966 . . . . 0.0 106.101 -177.412 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.445 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.1 pt-20 -56.18 -32.75 64.64 Favored 'General case' 0 C--N 1.282 -2.331 0 CA-C-O 122.952 1.358 . . . . 0.0 108.856 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 355' ' ' ILE . . . . . 0.415 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.0 tp -70.67 -28.04 32.97 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.693 0 CA-C-N 113.995 -1.457 . . . . 0.0 110.515 -177.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -112.51 -9.89 13.76 Favored 'General case' 0 C--N 1.265 -3.066 0 CA-C-N 113.743 -1.572 . . . . 0.0 111.404 -177.074 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.577 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.1 tp -107.82 -4.9 17.61 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.424 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.281 -2.377 0 CA-C-N 113.081 -1.872 . . . . 0.0 109.932 179.108 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 25.6 t . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 57.65 -140.98 0.78 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.281 -0.887 . . . . 0.0 109.814 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 341' ' ' LYS . . . . . 0.541 ' CD ' ' N ' ' A' ' 341' ' ' LYS . 10.3 mptt -86.4 120.25 27.54 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 123.104 1.431 . . . . 0.0 110.812 -178.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 342' ' ' GLU . . . . . 0.565 ' C ' ' H ' ' A' ' 344' ' ' ASP . 0.1 OUTLIER -124.22 -56.48 1.63 Allowed 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 106.191 -1.781 . . . . 0.0 106.191 179.9 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.628 ' O ' HG22 ' A' ' 343' ' ' VAL . 7.6 p -75.1 17.2 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-O 122.467 1.127 . . . . 0.0 109.097 178.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.565 ' H ' ' C ' ' A' ' 342' ' ' GLU . 5.1 t70 -160.41 -30.03 0.06 Allowed 'General case' 0 C--N 1.277 -2.571 0 C-N-CA 118.919 -1.112 . . . . 0.0 110.047 -178.643 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 345' ' ' GLU . . . . . 0.486 ' O ' ' O ' ' A' ' 344' ' ' ASP . 27.8 mt-10 53.7 150.56 0.0 OUTLIER 'General case' 0 C--N 1.276 -2.606 0 CA-C-O 122.243 1.02 . . . . 0.0 111.655 178.152 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.472 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 2.5 t -145.03 -0.14 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 CA-C-O 122.323 1.059 . . . . 0.0 108.678 179.528 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 347' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 4.4 t70 -91.09 15.34 11.86 Favored 'General case' 0 C--N 1.279 -2.459 0 CA-C-O 122.251 1.024 . . . . 0.0 109.071 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.93 -10.91 9.02 Favored 'General case' 0 C--N 1.272 -2.782 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.56 -33.53 58.5 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.585 -1.189 . . . . 0.0 108.189 178.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.424 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -70.75 -9.67 57.82 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 27.1 t -114.45 19.53 16.11 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -123.42 13.42 9.49 Favored 'General case' 0 C--N 1.28 -2.455 0 CA-C-N 113.816 -1.538 . . . . 0.0 108.39 -177.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.541 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.3 tp -119.4 -61.86 1.57 Allowed 'General case' 0 C--N 1.26 -3.299 0 CA-C-N 113.041 -1.89 . . . . 0.0 106.252 -177.235 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.454 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.2 pt-20 -56.27 -29.24 60.86 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 114.095 -1.412 . . . . 0.0 109.041 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.0 tp -76.49 -22.57 15.29 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.685 0 CA-C-N 113.768 -1.56 . . . . 0.0 110.69 -177.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 356' ' ' THR . . . . . 0.452 ' C ' ' H ' ' A' ' 358' ' ' GLU . 3.0 t -118.78 -11.86 9.73 Favored 'General case' 0 C--N 1.27 -2.879 0 CA-C-N 113.897 -1.501 . . . . 0.0 112.527 -176.499 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.541 ' N ' ' O ' ' A' ' 353' ' ' LEU . 7.7 tp -93.72 17.2 12.29 Favored 'General case' 0 C--N 1.286 -2.171 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 179.504 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.452 ' H ' ' C ' ' A' ' 356' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.283 -2.318 0 CA-C-N 113.123 -1.853 . . . . 0.0 109.667 -177.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 20.6 m . . . . . 0 N--CA 1.49 1.525 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -156.99 -36.16 0.08 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.22 -0.925 . . . . 0.0 109.548 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 341' ' ' LYS . . . . . 0.652 ' O ' ' N ' ' A' ' 343' ' ' VAL . 13.3 mttt 59.99 -129.29 1.04 Allowed 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.415 -0.803 . . . . 0.0 110.932 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 342' ' ' GLU . . . . . 0.454 ' C ' ' O ' ' A' ' 341' ' ' LYS . 0.0 OUTLIER 22.04 -76.58 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 122.045 0.926 . . . . 0.0 111.519 -179.84 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 343' ' ' VAL . . . . . 0.652 ' N ' ' O ' ' A' ' 341' ' ' LYS . 5.0 p -87.08 31.37 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.293 -1.87 0 CA-C-O 121.932 0.872 . . . . 0.0 110.29 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 344' ' ' ASP . . . . . 0.584 ' N ' ' O ' ' A' ' 341' ' ' LYS . 6.7 t70 -169.59 177.86 4.39 Favored 'General case' 0 C--N 1.283 -2.325 0 C-N-CA 118.769 -1.172 . . . . 0.0 110.981 -178.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 345' ' ' GLU . . . . . 0.484 ' N ' ' CG ' ' A' ' 344' ' ' ASP . 28.3 mt-10 58.82 147.32 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 121.85 0.833 . . . . 0.0 110.073 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 346' ' ' VAL . . . . . 0.472 ' O ' HG12 ' A' ' 346' ' ' VAL . 9.1 t -151.87 -3.68 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 CA-C-O 121.962 0.887 . . . . 0.0 109.782 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 347' ' ' ASP . . . . . 0.446 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 4.8 t70 -92.26 14.88 15.02 Favored 'General case' 0 C--N 1.277 -2.573 0 CA-C-O 122.324 1.059 . . . . 0.0 108.767 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.12 -11.0 9.31 Favored 'General case' 0 C--N 1.272 -2.768 0 N-CA-C 105.438 -2.06 . . . . 0.0 105.438 178.26 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.27 -33.92 59.13 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 114.606 -1.179 . . . . 0.0 108.403 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 350' ' ' LEU . . . . . 0.446 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -70.16 -8.97 54.01 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 32.6 t -115.57 20.28 14.81 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -124.64 11.68 8.53 Favored 'General case' 0 C--N 1.279 -2.472 0 CA-C-O 123.359 1.552 . . . . 0.0 108.558 -177.287 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.7 tp -119.51 -62.08 1.54 Allowed 'General case' 0 C--N 1.258 -3.381 0 CA-C-N 113.033 -1.894 . . . . 0.0 106.141 -177.492 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 354' ' ' GLU . . . . . 0.44 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.3 pt-20 -56.11 -32.14 63.93 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 114.274 -1.33 . . . . 0.0 108.867 179.474 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 355' ' ' ILE . . . . . 0.415 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.6 tp -71.29 -27.71 30.05 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.691 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.506 -177.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 356' ' ' THR . . . . . 0.401 HG22 ' H ' ' A' ' 356' ' ' THR . 3.6 t -112.97 -9.54 13.59 Favored 'General case' 0 C--N 1.266 -3.053 0 CA-C-N 113.754 -1.566 . . . . 0.0 111.542 -177.004 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.5 tp -108.86 -3.77 17.37 Favored 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 105.701 -1.963 . . . . 0.0 105.701 179.287 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.4 ' HG3' ' H ' ' A' ' 358' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.33 0 CA-C-N 113.161 -1.836 . . . . 0.0 109.959 179.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . 0.477 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.6 t . . . . . 0 N--CA 1.494 1.759 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -93.72 16.68 13.4 Favored 'General case' 0 C--N 1.278 -2.535 0 CA-C-O 122.666 1.222 . . . . 0.0 108.751 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -130.08 -9.62 4.31 Favored 'General case' 0 C--N 1.273 -2.738 0 N-CA-C 104.847 -2.279 . . . . 0.0 104.847 177.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.94 -31.43 56.61 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 114.281 -1.327 . . . . 0.0 107.762 178.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.41 ' N ' HD23 ' A' ' 350' ' ' LEU . 1.6 pt? -70.57 -9.2 56.24 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.3 t -116.65 20.22 14.15 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -124.5 10.88 8.55 Favored 'General case' 0 C--N 1.281 -2.405 0 CA-C-O 123.26 1.505 . . . . 0.0 108.735 -177.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.573 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.5 tp -119.43 -62.2 1.53 Allowed 'General case' 0 C--N 1.259 -3.359 0 CA-C-N 113.098 -1.865 . . . . 0.0 106.046 -177.454 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.443 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 9.9 pt-20 -56.5 -32.35 64.97 Favored 'General case' 0 C--N 1.282 -2.333 0 CA-C-O 122.861 1.315 . . . . 0.0 108.815 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . 0.409 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.1 tp -70.81 -27.95 32.23 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.684 0 CA-C-N 114.135 -1.393 . . . . 0.0 110.384 -177.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.5 t -112.5 -9.72 13.77 Favored 'General case' 0 C--N 1.266 -3.036 0 CA-C-N 113.78 -1.555 . . . . 0.0 111.503 -177.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.573 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.7 tp . . . . . 0 C--N 1.29 -1.981 0 N-CA-C 105.765 -1.939 . . . . 0.0 105.765 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . 0.464 ' O ' HG12 ' A' ' 346' ' ' VAL . 13.8 t . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.926 0.869 . . . . 0.0 109.532 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.3 t0 -96.16 15.86 19.71 Favored 'General case' 0 C--N 1.278 -2.509 0 CA-C-O 122.532 1.158 . . . . 0.0 108.453 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -123.55 -12.9 7.65 Favored 'General case' 0 C--N 1.271 -2.829 0 N-CA-C 105.008 -2.219 . . . . 0.0 105.008 177.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -73.26 -27.19 61.43 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.307 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.424 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -78.35 -10.46 59.69 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . 0.42 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 23.0 t -113.27 10.44 18.49 Favored 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.255 15.7 t70 -107.72 6.91 28.11 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-O 123.822 1.773 . . . . 0.0 107.689 -179.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.848 HD23 ' N ' ' A' ' 354' ' ' GLU 0.315 0.2 OUTLIER -106.24 -53.14 2.68 Favored 'General case' 0 C--N 1.257 -3.441 0 CA-C-N 112.061 -2.336 . . . . 0.0 106.849 -177.794 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.848 ' N ' HD23 ' A' ' 353' ' ' LEU . 18.8 pt-20 -51.17 -34.24 30.61 Favored 'General case' 0 C--N 1.283 -2.304 0 CA-C-N 113.598 -1.637 . . . . 0.0 108.676 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . 0.49 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -70.37 -15.3 18.96 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.374 0 CA-C-N 113.547 -1.66 . . . . 0.0 110.181 -178.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.4 t -134.22 -4.75 2.69 Favored 'General case' 0 C--N 1.282 -2.349 0 C-N-CA 119.59 -0.844 . . . . 0.0 112.883 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 353' ' ' LEU . 9.8 tp . . . . . 0 C--N 1.284 -2.24 0 N-CA-C 104.726 -2.324 . . . . 0.0 104.726 177.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . 0.494 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.7 t . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 122.476 1.131 . . . . 0.0 108.862 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . 0.445 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 5.6 t0 -90.46 14.38 13.18 Favored 'General case' 0 C--N 1.278 -2.503 0 CA-C-O 122.232 1.015 . . . . 0.0 108.925 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.7 -9.89 9.27 Favored 'General case' 0 C--N 1.274 -2.71 0 N-CA-C 105.53 -2.026 . . . . 0.0 105.53 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -77.2 -33.65 56.29 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 114.701 -1.136 . . . . 0.0 108.18 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.445 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -69.97 -9.24 54.45 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 28.6 t -115.2 20.26 15.06 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -124.84 11.54 8.39 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.237 1.494 . . . . 0.0 108.625 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.3 tp -119.56 -61.7 1.59 Allowed 'General case' 0 C--N 1.259 -3.366 0 CA-C-N 113.132 -1.849 . . . . 0.0 106.25 -177.463 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.444 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 14.0 pt-20 -56.52 -29.14 61.53 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-N 114.079 -1.419 . . . . 0.0 108.95 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.1 tp -75.59 -23.28 16.58 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.643 0 CA-C-N 113.881 -1.509 . . . . 0.0 110.551 -177.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.1 t -118.69 -11.15 9.88 Favored 'General case' 0 C--N 1.269 -2.907 0 CA-C-N 113.835 -1.529 . . . . 0.0 112.677 -176.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.54 ' N ' ' O ' ' A' ' 353' ' ' LEU . 7.9 tp . . . . . 0 C--N 1.286 -2.16 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . 0.47 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.6 t . . . . . 0 N--CA 1.496 1.845 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -95.71 17.69 14.51 Favored 'General case' 0 C--N 1.279 -2.476 0 CA-C-O 122.849 1.309 . . . . 0.0 108.55 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -131.84 -9.79 3.5 Favored 'General case' 0 C--N 1.272 -2.78 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 177.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -75.92 -33.27 59.88 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.124 -1.398 . . . . 0.0 107.6 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.423 ' N ' HD23 ' A' ' 350' ' ' LEU . 1.6 pt? -68.4 -9.23 46.9 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.6 t -117.36 20.67 13.52 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -125.43 11.33 8.02 Favored 'General case' 0 C--N 1.279 -2.458 0 CA-C-O 123.315 1.531 . . . . 0.0 108.521 -177.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.592 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.257 4.5 tp -118.75 -61.97 1.59 Allowed 'General case' 0 C--N 1.258 -3.383 0 CA-C-N 113.019 -1.901 . . . . 0.0 106.083 -177.561 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.44 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 18.5 pt-20 -55.96 -32.31 63.76 Favored 'General case' 0 C--N 1.283 -2.309 0 CA-C-O 122.942 1.353 . . . . 0.0 108.851 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . 0.421 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.87 -27.8 31.56 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.675 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.446 -177.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . 0.405 ' H ' HG22 ' A' ' 356' ' ' THR . 3.4 t -113.05 -9.52 13.55 Favored 'General case' 0 C--N 1.267 -3.006 0 CA-C-N 113.721 -1.581 . . . . 0.0 111.503 -177.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.592 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.9 tp . . . . . 0 C--N 1.289 -2.025 0 N-CA-C 105.774 -1.935 . . . . 0.0 105.774 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 346' ' ' VAL . 5.4 t . . . . . 0 N--CA 1.494 1.737 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -95.32 17.78 13.76 Favored 'General case' 0 C--N 1.279 -2.495 0 CA-C-O 122.828 1.299 . . . . 0.0 108.525 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -134.16 -8.34 2.64 Favored 'General case' 0 C--N 1.272 -2.762 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 177.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -78.58 -33.47 47.61 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 114.044 -1.435 . . . . 0.0 107.461 178.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.439 ' N ' HD23 ' A' ' 350' ' ' LEU . 1.7 pt? -67.74 -8.84 38.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 29.2 t -116.76 21.18 13.56 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -128.56 9.02 5.95 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.34 1.543 . . . . 0.0 108.523 -177.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -118.85 -61.74 1.61 Allowed 'General case' 0 C--N 1.259 -3.347 0 CA-C-N 113.092 -1.867 . . . . 0.0 105.985 -177.634 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.438 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.0 pt-20 -56.55 -31.99 64.71 Favored 'General case' 0 C--N 1.283 -2.297 0 CA-C-O 122.889 1.328 . . . . 0.0 108.872 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . 0.41 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.3 tp -70.88 -27.48 30.44 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.642 0 CA-C-N 114.11 -1.405 . . . . 0.0 110.331 -178.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.5 t -113.63 -9.49 13.21 Favored 'General case' 0 C--N 1.268 -2.969 0 CA-C-N 113.777 -1.556 . . . . 0.0 111.755 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.9 tp . . . . . 0 C--N 1.288 -2.068 0 N-CA-C 105.677 -1.971 . . . . 0.0 105.677 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . 0.428 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t . . . . . 0 N--CA 1.487 1.417 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . 0.465 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 1.0 OUTLIER -94.67 12.74 26.64 Favored 'General case' 0 C--N 1.276 -2.614 0 CA-C-N 113.671 -1.604 . . . . 0.0 107.058 179.652 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -118.8 -11.43 9.78 Favored 'General case' 0 C--N 1.276 -2.627 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 178.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.98 -34.91 57.52 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.588 -1.187 . . . . 0.0 108.379 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.465 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -69.1 -9.75 54.21 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.0 t -113.44 19.67 16.73 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -126.15 12.65 7.72 Favored 'General case' 0 C--N 1.279 -2.465 0 CA-C-O 123.493 1.616 . . . . 0.0 108.067 -177.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.591 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.262 4.7 tp -117.99 -61.49 1.67 Allowed 'General case' 0 C--N 1.26 -3.307 0 CA-C-N 112.79 -2.005 . . . . 0.0 106.045 -177.569 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.433 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 12.2 pt-20 -55.76 -32.67 63.63 Favored 'General case' 0 C--N 1.283 -2.29 0 CA-C-O 122.943 1.354 . . . . 0.0 108.857 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . 0.425 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.74 -27.25 30.03 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.712 0 CA-C-N 113.967 -1.469 . . . . 0.0 110.436 -177.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -113.84 -9.06 13.13 Favored 'General case' 0 C--N 1.266 -3.035 0 CA-C-N 113.804 -1.543 . . . . 0.0 111.32 -177.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.591 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.7 tp . . . . . 0 C--N 1.288 -2.066 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . 0.469 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t . . . . . 0 N--CA 1.495 1.817 0 CA-C-O 122.784 1.278 . . . . 0.0 107.684 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . 0.451 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 2.3 t0 -88.25 14.35 9.58 Favored 'General case' 0 C--N 1.276 -2.605 0 CA-C-O 122.147 0.975 . . . . 0.0 109.076 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.69 -9.28 9.37 Favored 'General case' 0 C--N 1.274 -2.689 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 178.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -78.2 -31.64 49.55 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.121 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.451 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -72.27 -9.82 58.98 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 22.9 t -113.52 17.63 18.2 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -121.07 15.03 11.52 Favored 'General case' 0 C--N 1.279 -2.475 0 CA-C-O 123.585 1.66 . . . . 0.0 107.844 -177.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.598 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.268 4.6 tp -117.19 -61.08 1.76 Allowed 'General case' 0 C--N 1.259 -3.332 0 CA-C-N 112.553 -2.112 . . . . 0.0 106.023 -177.538 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 355' ' ' ILE . 10.1 pt-20 -55.43 -33.8 63.89 Favored 'General case' 0 C--N 1.283 -2.304 0 CA-C-O 122.965 1.364 . . . . 0.0 108.791 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . 0.431 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 3.8 tp -69.49 -27.18 33.11 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.667 0 CA-C-N 114.013 -1.449 . . . . 0.0 110.535 -178.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -114.22 -8.7 12.92 Favored 'General case' 0 C--N 1.266 -3.057 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.404 -177.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.598 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.4 tp . . . . . 0 C--N 1.289 -2.052 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . 0.466 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 4.4 t . . . . . 0 N--CA 1.494 1.747 0 CA-C-O 122.206 1.003 . . . . 0.0 108.568 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -94.76 17.42 13.58 Favored 'General case' 0 C--N 1.28 -2.438 0 CA-C-O 122.607 1.194 . . . . 0.0 108.789 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . 0.417 ' H ' ' H ' ' A' ' 349' ' ' ALA . . . -129.18 -10.8 4.71 Favored 'General case' 0 C--N 1.272 -2.802 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 177.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . 0.417 ' H ' ' H ' ' A' ' 348' ' ' ALA . . . -75.76 -25.42 56.47 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 114.299 -1.319 . . . . 0.0 108.068 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -77.63 -11.38 59.86 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 30.1 t -112.75 9.2 19.09 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.261 47.1 t0 -107.36 8.85 29.88 Favored 'General case' 0 C--N 1.281 -2.372 0 CA-C-O 123.829 1.776 . . . . 0.0 107.577 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.445 HD23 ' N ' ' A' ' 354' ' ' GLU 0.319 0.0 OUTLIER -106.22 -56.55 2.17 Favored 'General case' 0 C--N 1.257 -3.417 0 CA-C-N 111.93 -2.396 . . . . 0.0 106.377 -177.654 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.472 ' CG ' ' N ' ' A' ' 355' ' ' ILE . 17.9 pt-20 -49.79 -32.29 13.63 Favored 'General case' 0 C--N 1.278 -2.542 0 CA-C-N 113.145 -1.843 . . . . 0.0 108.823 -178.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . 0.472 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -72.93 -17.27 18.08 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.307 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.666 -178.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 1.8 t -128.88 -12.98 4.7 Favored 'General case' 0 C--N 1.282 -2.351 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -173.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 357' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.281 -2.385 0 N-CA-C 105.517 -2.031 . . . . 0.0 105.517 178.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . 0.473 ' O ' HG12 ' A' ' 346' ' ' VAL . 3.8 t . . . . . 0 N--CA 1.496 1.847 0 CA-C-O 122.402 1.096 . . . . 0.0 108.258 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . 0.407 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.1 t70 -93.77 14.55 18.94 Favored 'General case' 0 C--N 1.278 -2.502 0 CA-C-O 122.481 1.134 . . . . 0.0 108.619 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -123.92 -10.04 7.72 Favored 'General case' 0 C--N 1.273 -2.725 0 N-CA-C 105.091 -2.189 . . . . 0.0 105.091 177.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.35 -31.66 58.2 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.474 -1.239 . . . . 0.0 108.091 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.407 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.4 pt? -71.26 -9.74 58.61 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 31.0 t -114.96 19.27 15.93 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -123.75 13.29 9.26 Favored 'General case' 0 C--N 1.279 -2.459 0 CA-C-O 123.481 1.61 . . . . 0.0 108.07 -177.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.571 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.264 4.2 tp -117.38 -60.08 1.87 Allowed 'General case' 0 C--N 1.259 -3.332 0 CA-C-N 112.773 -2.012 . . . . 0.0 106.105 -177.378 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.429 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.1 pt-20 -57.17 -32.67 66.67 Favored 'General case' 0 C--N 1.282 -2.332 0 CA-C-O 123.052 1.406 . . . . 0.0 108.865 179.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . 0.423 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.99 -26.71 28.04 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.65 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.509 -177.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.3 t -113.26 -12.19 13.11 Favored 'General case' 0 C--N 1.266 -3.036 0 CA-C-N 113.826 -1.534 . . . . 0.0 111.461 -177.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.866 HD13 ' O ' ' A' ' 357' ' ' LEU . 2.6 tm? . . . . . 0 C--N 1.288 -2.066 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . 0.455 ' O ' HG12 ' A' ' 346' ' ' VAL . 5.4 t . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -99.54 16.2 24.08 Favored 'General case' 0 C--N 1.276 -2.594 0 CA-C-O 122.976 1.369 . . . . 0.0 107.789 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -128.46 -10.79 5.12 Favored 'General case' 0 C--N 1.272 -2.785 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 177.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -74.96 -32.63 61.75 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.319 -1.309 . . . . 0.0 107.99 178.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -70.21 -9.05 54.62 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.0 t -117.38 20.53 13.57 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -124.63 11.28 8.51 Favored 'General case' 0 C--N 1.28 -2.416 0 CA-C-O 123.376 1.56 . . . . 0.0 108.569 -177.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.578 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -119.45 -62.24 1.53 Allowed 'General case' 0 C--N 1.258 -3.39 0 CA-C-N 113.016 -1.902 . . . . 0.0 106.179 -177.372 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.44 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 11.2 pt-20 -55.99 -32.07 63.61 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-O 122.976 1.369 . . . . 0.0 108.894 179.338 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . 0.411 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.3 tp -70.98 -28.23 32.67 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.662 0 CA-C-N 113.999 -1.455 . . . . 0.0 110.375 -178.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . 0.418 ' H ' HG22 ' A' ' 356' ' ' THR . 3.5 t -112.88 -9.36 13.65 Favored 'General case' 0 C--N 1.267 -3.003 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.764 -176.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.578 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.0 tp . . . . . 0 C--N 1.289 -2.027 0 N-CA-C 105.782 -1.933 . . . . 0.0 105.782 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . 0.46 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.2 t . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -94.6 17.07 13.95 Favored 'General case' 0 C--N 1.278 -2.5 0 CA-C-O 122.621 1.201 . . . . 0.0 108.456 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -128.54 -9.27 5.12 Favored 'General case' 0 C--N 1.272 -2.78 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 177.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -78.35 -22.72 47.58 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 114.294 -1.321 . . . . 0.0 108.049 178.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -80.52 -11.19 59.7 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . 0.425 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 12.6 t -111.61 9.85 21.11 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.256 25.2 t0 -108.18 7.83 27.68 Favored 'General case' 0 C--N 1.281 -2.375 0 CA-C-O 123.891 1.805 . . . . 0.0 107.671 -179.335 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.907 HD23 ' N ' ' A' ' 354' ' ' GLU 0.318 0.5 OUTLIER -106.72 -53.41 2.62 Favored 'General case' 0 C--N 1.257 -3.43 0 CA-C-N 111.983 -2.372 . . . . 0.0 107.026 -177.676 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.907 ' N ' HD23 ' A' ' 353' ' ' LEU . 19.8 pt-20 -50.55 -34.76 26.75 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 113.563 -1.653 . . . . 0.0 108.635 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . 0.504 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -70.62 -14.87 18.48 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.338 0 CA-C-N 113.664 -1.607 . . . . 0.0 110.304 -178.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.3 t -133.97 -4.36 2.8 Favored 'General case' 0 C--N 1.28 -2.426 0 C-N-CA 119.586 -0.846 . . . . 0.0 112.583 -174.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.527 ' N ' ' O ' ' A' ' 353' ' ' LEU . 9.8 tp . . . . . 0 C--N 1.284 -2.258 0 N-CA-C 104.563 -2.384 . . . . 0.0 104.563 177.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . . . . . . . . . 41.4 t . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 122.092 0.949 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . 0.45 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.0 t0 -93.58 16.11 14.5 Favored 'General case' 0 C--N 1.272 -2.775 0 CA-C-O 122.659 1.218 . . . . 0.0 108.094 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -121.87 -14.87 7.99 Favored 'General case' 0 C--N 1.272 -2.785 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 178.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -70.66 -28.15 64.57 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.494 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.45 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -78.51 -10.36 59.68 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . 0.42 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 43.5 t -113.5 10.77 18.24 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 179.526 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.254 34.8 t0 -107.82 7.57 28.27 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-O 123.902 1.811 . . . . 0.0 107.662 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.921 HD23 ' N ' ' A' ' 354' ' ' GLU 0.321 0.4 OUTLIER -106.41 -54.0 2.54 Favored 'General case' 0 C--N 1.256 -3.473 0 CA-C-N 111.988 -2.369 . . . . 0.0 107.03 -177.471 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.921 ' N ' HD23 ' A' ' 353' ' ' LEU . 17.2 pt-20 -50.53 -34.48 25.55 Favored 'General case' 0 C--N 1.282 -2.33 0 CA-C-N 113.911 -1.495 . . . . 0.0 108.712 179.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . 0.504 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.6 mt -69.31 -16.06 20.26 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.355 0 CA-C-N 113.623 -1.626 . . . . 0.0 110.128 -178.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 1.9 t -132.12 -5.87 3.46 Favored 'General case' 0 C--N 1.283 -2.322 0 C-N-CA 119.683 -0.807 . . . . 0.0 112.737 -174.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.506 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.286 -2.187 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 177.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . 0.471 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.6 t . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 122.422 1.106 . . . . 0.0 108.183 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -93.35 14.67 17.7 Favored 'General case' 0 C--N 1.278 -2.517 0 CA-C-O 122.505 1.145 . . . . 0.0 108.595 179.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -125.03 -10.15 7.13 Favored 'General case' 0 C--N 1.273 -2.739 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 177.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.2 -31.35 58.39 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.414 -1.266 . . . . 0.0 108.065 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -71.57 -9.77 58.74 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.9 t -115.28 19.14 15.77 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -122.88 13.44 9.87 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.483 1.611 . . . . 0.0 108.258 -177.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.264 5.7 tp -118.55 -63.74 1.37 Allowed 'General case' 0 C--N 1.258 -3.378 0 CA-C-N 112.763 -2.017 . . . . 0.0 105.993 -177.554 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.442 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.0 pt-20 -53.74 -32.06 50.74 Favored 'General case' 0 C--N 1.283 -2.323 0 CA-C-O 123.029 1.395 . . . . 0.0 108.999 179.234 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . 0.412 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.1 tp -72.26 -25.63 23.61 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.663 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.69 -177.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.3 t -114.96 -13.5 11.92 Favored 'General case' 0 C--N 1.267 -3.021 0 CA-C-N 114.074 -1.421 . . . . 0.0 112.513 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.282 -2.357 0 N-CA-C 105.142 -2.17 . . . . 0.0 105.142 179.079 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . 0.463 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.9 t . . . . . 0 N--CA 1.494 1.753 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -97.42 18.24 15.73 Favored 'General case' 0 C--N 1.28 -2.416 0 CA-C-O 123.003 1.382 . . . . 0.0 108.205 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . 0.432 ' H ' ' H ' ' A' ' 349' ' ' ALA . . . -133.89 -11.08 2.66 Favored 'General case' 0 C--N 1.272 -2.795 0 N-CA-C 104.358 -2.46 . . . . 0.0 104.358 177.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . 0.432 ' H ' ' H ' ' A' ' 348' ' ' ALA . . . -74.38 -34.1 63.24 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 113.96 -1.473 . . . . 0.0 107.591 178.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.445 ' N ' HD23 ' A' ' 350' ' ' LEU . 1.7 pt? -67.7 -8.75 37.69 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 27.3 t -118.45 20.63 12.96 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 123.096 1.426 . . . . 0.0 107.198 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -125.11 8.66 7.98 Favored 'General case' 0 C--N 1.279 -2.496 0 CA-C-O 123.386 1.565 . . . . 0.0 108.146 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.557 HD23 ' N ' ' A' ' 354' ' ' GLU 0.288 0.1 OUTLIER -113.31 -60.19 1.92 Allowed 'General case' 0 C--N 1.258 -3.372 0 CA-C-N 112.785 -2.007 . . . . 0.0 105.953 -178.638 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.557 ' N ' HD23 ' A' ' 353' ' ' LEU . 23.4 pt-20 -54.15 -34.86 61.44 Favored 'General case' 0 C--N 1.276 -2.609 0 CA-C-N 114.026 -1.443 . . . . 0.0 109.253 -178.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . 0.433 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 6.3 tp -69.04 -26.8 33.1 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.591 0 CA-C-N 113.812 -1.54 . . . . 0.0 111.061 -177.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . 0.418 ' H ' HG22 ' A' ' 356' ' ' THR . 3.4 t -112.93 -15.52 12.86 Favored 'General case' 0 C--N 1.265 -3.067 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.197 -176.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.291 -1.967 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . 0.443 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t . . . . . 0 N--CA 1.488 1.439 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . 0.462 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 0.6 OUTLIER -95.39 13.49 25.64 Favored 'General case' 0 C--N 1.275 -2.672 0 CA-C-N 113.879 -1.509 . . . . 0.0 107.441 179.9 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -121.17 -11.81 8.78 Favored 'General case' 0 C--N 1.274 -2.691 0 N-CA-C 105.234 -2.136 . . . . 0.0 105.234 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.15 -25.92 55.76 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.424 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.462 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -80.28 -10.51 59.76 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . 0.42 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 29.8 t -111.11 10.55 21.97 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.255 46.4 t0 -107.94 6.48 27.26 Favored 'General case' 0 C--N 1.281 -2.383 0 CA-C-O 123.875 1.797 . . . . 0.0 107.643 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.861 HD23 ' N ' ' A' ' 354' ' ' GLU 0.317 0.2 OUTLIER -105.95 -52.97 2.72 Favored 'General case' 0 C--N 1.258 -3.403 0 CA-C-N 112.011 -2.359 . . . . 0.0 106.891 -177.784 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.861 ' N ' HD23 ' A' ' 353' ' ' LEU . 18.6 pt-20 -51.3 -33.9 30.89 Favored 'General case' 0 C--N 1.283 -2.322 0 CA-C-N 113.661 -1.609 . . . . 0.0 108.556 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . 0.498 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.5 mt -70.31 -15.37 19.05 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.368 0 CA-C-N 113.5 -1.682 . . . . 0.0 110.111 -178.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.3 t -134.07 -4.74 2.74 Favored 'General case' 0 C--N 1.281 -2.374 0 C-N-CA 119.671 -0.811 . . . . 0.0 112.886 -174.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' A' ' 353' ' ' LEU . 10.4 tp . . . . . 0 C--N 1.284 -2.257 0 N-CA-C 104.783 -2.303 . . . . 0.0 104.783 177.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . 0.46 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t . . . . . 0 N--CA 1.496 1.868 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -97.35 16.53 19.8 Favored 'General case' 0 C--N 1.281 -2.388 0 CA-C-O 122.592 1.187 . . . . 0.0 108.576 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -127.56 -10.26 5.65 Favored 'General case' 0 C--N 1.272 -2.769 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.94 -24.61 52.38 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 114.286 -1.325 . . . . 0.0 108.145 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -79.22 -11.13 59.96 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 39.5 t -111.93 8.7 20.42 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.267 13.5 t70 -106.86 11.27 30.21 Favored 'General case' 0 C--N 1.282 -2.366 0 CA-C-O 123.691 1.71 . . . . 0.0 107.798 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.48 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.307 0.0 OUTLIER -107.84 -58.91 1.91 Allowed 'General case' 0 C--N 1.257 -3.432 0 CA-C-N 112.112 -2.313 . . . . 0.0 106.3 -177.242 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.476 ' CG ' ' N ' ' A' ' 355' ' ' ILE . 16.1 pt-20 -47.93 -32.58 6.55 Favored 'General case' 0 C--N 1.281 -2.376 0 CA-C-N 113.223 -1.808 . . . . 0.0 108.978 -178.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . 0.476 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.3 mt -73.34 -17.49 17.75 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.319 0 CA-C-N 113.622 -1.626 . . . . 0.0 110.658 -178.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.1 t -130.51 -11.11 4.02 Favored 'General case' 0 C--N 1.28 -2.415 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -173.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.48 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.281 -2.39 0 N-CA-C 105.44 -2.059 . . . . 0.0 105.44 178.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . . . . . . . . . 3.7 t . . . . . 0 N--CA 1.487 1.401 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . 0.462 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.0 t70 -96.68 13.85 26.95 Favored 'General case' 0 C--N 1.276 -2.618 0 CA-C-N 113.573 -1.648 . . . . 0.0 106.939 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -118.98 -13.72 9.42 Favored 'General case' 0 C--N 1.273 -2.726 0 N-CA-C 105.28 -2.118 . . . . 0.0 105.28 178.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -73.75 -35.21 65.0 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.554 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.462 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -69.36 -9.31 52.86 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.1 t -115.43 20.13 15.0 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -124.16 13.01 8.97 Favored 'General case' 0 C--N 1.28 -2.438 0 CA-C-O 123.39 1.567 . . . . 0.0 108.352 -177.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.577 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -118.53 -61.67 1.63 Allowed 'General case' 0 C--N 1.258 -3.391 0 CA-C-N 112.876 -1.966 . . . . 0.0 106.101 -177.412 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.445 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.1 pt-20 -56.18 -32.75 64.64 Favored 'General case' 0 C--N 1.282 -2.331 0 CA-C-O 122.952 1.358 . . . . 0.0 108.856 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . 0.415 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.0 tp -70.67 -28.04 32.97 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.693 0 CA-C-N 113.995 -1.457 . . . . 0.0 110.515 -177.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -112.51 -9.89 13.76 Favored 'General case' 0 C--N 1.265 -3.066 0 CA-C-N 113.743 -1.572 . . . . 0.0 111.404 -177.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.577 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.1 tp . . . . . 0 C--N 1.289 -2.055 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . 0.472 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 2.5 t . . . . . 0 N--CA 1.498 1.952 0 CA-C-O 122.323 1.059 . . . . 0.0 108.678 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 4.4 t70 -91.09 15.34 11.86 Favored 'General case' 0 C--N 1.279 -2.459 0 CA-C-O 122.251 1.024 . . . . 0.0 109.071 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.93 -10.91 9.02 Favored 'General case' 0 C--N 1.272 -2.782 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.56 -33.53 58.5 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.585 -1.189 . . . . 0.0 108.189 178.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.424 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -70.75 -9.67 57.82 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 27.1 t -114.45 19.53 16.11 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -123.42 13.42 9.49 Favored 'General case' 0 C--N 1.28 -2.455 0 CA-C-N 113.816 -1.538 . . . . 0.0 108.39 -177.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.541 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.3 tp -119.4 -61.86 1.57 Allowed 'General case' 0 C--N 1.26 -3.299 0 CA-C-N 113.041 -1.89 . . . . 0.0 106.252 -177.235 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.454 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.2 pt-20 -56.27 -29.24 60.86 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 114.095 -1.412 . . . . 0.0 109.041 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.0 tp -76.49 -22.57 15.29 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.685 0 CA-C-N 113.768 -1.56 . . . . 0.0 110.69 -177.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.0 t -118.78 -11.86 9.73 Favored 'General case' 0 C--N 1.27 -2.879 0 CA-C-N 113.897 -1.501 . . . . 0.0 112.527 -176.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.541 ' N ' ' O ' ' A' ' 353' ' ' LEU . 7.7 tp . . . . . 0 C--N 1.286 -2.171 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 346' ' ' VAL . . . . . 0.472 ' O ' HG12 ' A' ' 346' ' ' VAL . 9.1 t . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 121.962 0.887 . . . . 0.0 109.782 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 347' ' ' ASP . . . . . 0.446 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 4.8 t70 -92.26 14.88 15.02 Favored 'General case' 0 C--N 1.277 -2.573 0 CA-C-O 122.324 1.059 . . . . 0.0 108.767 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.12 -11.0 9.31 Favored 'General case' 0 C--N 1.272 -2.768 0 N-CA-C 105.438 -2.06 . . . . 0.0 105.438 178.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.27 -33.92 59.13 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 114.606 -1.179 . . . . 0.0 108.403 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 350' ' ' LEU . . . . . 0.446 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -70.16 -8.97 54.01 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 32.6 t -115.57 20.28 14.81 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -124.64 11.68 8.53 Favored 'General case' 0 C--N 1.279 -2.472 0 CA-C-O 123.359 1.552 . . . . 0.0 108.558 -177.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 353' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.7 tp -119.51 -62.08 1.54 Allowed 'General case' 0 C--N 1.258 -3.381 0 CA-C-N 113.033 -1.894 . . . . 0.0 106.141 -177.492 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 354' ' ' GLU . . . . . 0.44 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.3 pt-20 -56.11 -32.14 63.93 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 114.274 -1.33 . . . . 0.0 108.867 179.474 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 355' ' ' ILE . . . . . 0.415 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.6 tp -71.29 -27.71 30.05 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.691 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.506 -177.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 356' ' ' THR . . . . . 0.401 HG22 ' H ' ' A' ' 356' ' ' THR . 3.6 t -112.97 -9.54 13.59 Favored 'General case' 0 C--N 1.266 -3.053 0 CA-C-N 113.754 -1.566 . . . . 0.0 111.542 -177.004 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.5 tp . . . . . 0 C--N 1.289 -2.023 0 N-CA-C 105.701 -1.963 . . . . 0.0 105.701 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 22.0 t . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 18.4 p30 -162.21 172.84 15.11 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.237 -0.915 . . . . 0.0 109.622 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . 0.42 ' O ' ' C ' ' A' ' 342' ' ' GLU . 0.0 OUTLIER -167.77 -26.77 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.283 -0.885 . . . . 0.0 109.826 -179.912 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . 0.42 ' C ' ' O ' ' A' ' 341' ' ' LYS . 0.0 OUTLIER -40.94 -83.04 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.467 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 2.1 p -92.04 -0.54 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 178.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.467 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 6.3 t70 75.17 -174.8 0.13 Allowed 'General case' 0 C--N 1.287 -2.149 0 CA-C-O 122.261 1.029 . . . . 0.0 110.493 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -84.28 168.59 15.54 Favored 'General case' 0 C--N 1.29 -1.992 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.28 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.477 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.6 t -118.79 -2.14 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -93.72 16.68 13.4 Favored 'General case' 0 C--N 1.278 -2.535 0 CA-C-O 122.666 1.222 . . . . 0.0 108.751 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -130.08 -9.62 4.31 Favored 'General case' 0 C--N 1.273 -2.738 0 N-CA-C 104.847 -2.279 . . . . 0.0 104.847 177.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.94 -31.43 56.61 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 114.281 -1.327 . . . . 0.0 107.762 178.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.41 ' N ' HD23 ' A' ' 350' ' ' LEU . 1.6 pt? -70.57 -9.2 56.24 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.3 t -116.65 20.22 14.15 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -124.5 10.88 8.55 Favored 'General case' 0 C--N 1.281 -2.405 0 CA-C-O 123.26 1.505 . . . . 0.0 108.735 -177.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.573 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.5 tp -119.43 -62.2 1.53 Allowed 'General case' 0 C--N 1.259 -3.359 0 CA-C-N 113.098 -1.865 . . . . 0.0 106.046 -177.454 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.443 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 9.9 pt-20 -56.5 -32.35 64.97 Favored 'General case' 0 C--N 1.282 -2.333 0 CA-C-O 122.861 1.315 . . . . 0.0 108.815 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . 0.409 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.1 tp -70.81 -27.95 32.23 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.684 0 CA-C-N 114.135 -1.393 . . . . 0.0 110.384 -177.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.5 t -112.5 -9.72 13.77 Favored 'General case' 0 C--N 1.266 -3.036 0 CA-C-N 113.78 -1.555 . . . . 0.0 111.503 -177.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.573 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.7 tp -109.29 -3.71 16.98 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 105.765 -1.939 . . . . 0.0 105.765 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.431 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.282 -2.331 0 CA-C-N 113.097 -1.865 . . . . 0.0 110.041 179.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 65.5 m . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . 0.51 ' N ' ' OD1' ' A' ' 340' ' ' ASP . 0.5 OUTLIER -75.86 -177.2 3.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.198 -0.939 . . . . 0.0 109.402 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . 0.407 ' O ' ' C ' ' A' ' 342' ' ' GLU . 0.0 OUTLIER -168.85 -27.24 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.25 -0.906 . . . . 0.0 109.731 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . 0.454 ' C ' ' H ' ' A' ' 344' ' ' ASP . 0.2 OUTLIER -41.91 -82.62 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.359 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.532 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 3.6 p -83.93 13.59 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 178.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.532 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 3.7 t70 83.98 -173.93 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.39 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -114.7 159.59 20.35 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-O 121.841 0.829 . . . . 0.0 109.573 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.464 ' O ' HG12 ' A' ' 346' ' ' VAL . 13.8 t -149.36 -5.74 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.297 -1.709 0 CA-C-O 121.926 0.869 . . . . 0.0 109.532 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.3 t0 -96.16 15.86 19.71 Favored 'General case' 0 C--N 1.278 -2.509 0 CA-C-O 122.532 1.158 . . . . 0.0 108.453 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -123.55 -12.9 7.65 Favored 'General case' 0 C--N 1.271 -2.829 0 N-CA-C 105.008 -2.219 . . . . 0.0 105.008 177.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -73.26 -27.19 61.43 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.307 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.424 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -78.35 -10.46 59.69 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . 0.42 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 23.0 t -113.27 10.44 18.49 Favored 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.255 15.7 t70 -107.72 6.91 28.11 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-O 123.822 1.773 . . . . 0.0 107.689 -179.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.848 HD23 ' N ' ' A' ' 354' ' ' GLU 0.315 0.2 OUTLIER -106.24 -53.14 2.68 Favored 'General case' 0 C--N 1.257 -3.441 0 CA-C-N 112.061 -2.336 . . . . 0.0 106.849 -177.794 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.848 ' N ' HD23 ' A' ' 353' ' ' LEU . 18.8 pt-20 -51.17 -34.24 30.61 Favored 'General case' 0 C--N 1.283 -2.304 0 CA-C-N 113.598 -1.637 . . . . 0.0 108.676 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . 0.49 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -70.37 -15.3 18.96 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.374 0 CA-C-N 113.547 -1.66 . . . . 0.0 110.181 -178.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.4 t -134.22 -4.75 2.69 Favored 'General case' 0 C--N 1.282 -2.349 0 C-N-CA 119.59 -0.844 . . . . 0.0 112.883 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 353' ' ' LEU . 9.8 tp -100.85 13.32 35.41 Favored 'General case' 0 C--N 1.284 -2.24 0 N-CA-C 104.726 -2.324 . . . . 0.0 104.726 177.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.401 ' HG3' ' H ' ' A' ' 358' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.286 -2.171 0 CA-C-N 113.006 -1.906 . . . . 0.0 109.515 -179.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 80.8 p . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . 0.506 ' C ' ' H ' ' A' ' 342' ' ' GLU . 61.5 m-20 -49.51 -88.84 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.242 -0.911 . . . . 0.0 109.425 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.08 -27.62 0.19 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.635 0.731 . . . . 0.0 109.861 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . 0.506 ' H ' ' C ' ' A' ' 340' ' ' ASP . 0.2 OUTLIER -47.32 -81.31 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 178.821 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.474 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 2.3 p -95.35 10.06 5.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.474 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 2.1 t70 79.01 -174.8 0.07 Allowed 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.07 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -116.61 160.88 20.03 Favored 'General case' 0 C--N 1.297 -1.694 0 CA-C-O 121.917 0.865 . . . . 0.0 109.801 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.494 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.7 t -147.67 0.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.695 0 CA-C-O 122.476 1.131 . . . . 0.0 108.862 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . 0.445 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 5.6 t0 -90.46 14.38 13.18 Favored 'General case' 0 C--N 1.278 -2.503 0 CA-C-O 122.232 1.015 . . . . 0.0 108.925 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.7 -9.89 9.27 Favored 'General case' 0 C--N 1.274 -2.71 0 N-CA-C 105.53 -2.026 . . . . 0.0 105.53 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -77.2 -33.65 56.29 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 114.701 -1.136 . . . . 0.0 108.18 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.445 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -69.97 -9.24 54.45 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 28.6 t -115.2 20.26 15.06 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -124.84 11.54 8.39 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.237 1.494 . . . . 0.0 108.625 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.3 tp -119.56 -61.7 1.59 Allowed 'General case' 0 C--N 1.259 -3.366 0 CA-C-N 113.132 -1.849 . . . . 0.0 106.25 -177.463 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.444 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 14.0 pt-20 -56.52 -29.14 61.53 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-N 114.079 -1.419 . . . . 0.0 108.95 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.1 tp -75.59 -23.28 16.58 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.643 0 CA-C-N 113.881 -1.509 . . . . 0.0 110.551 -177.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.1 t -118.69 -11.15 9.88 Favored 'General case' 0 C--N 1.269 -2.907 0 CA-C-N 113.835 -1.529 . . . . 0.0 112.677 -176.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.54 ' N ' ' O ' ' A' ' 353' ' ' LEU . 7.9 tp -97.93 17.55 17.96 Favored 'General case' 0 C--N 1.286 -2.16 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.283 -2.32 0 CA-C-N 113.19 -1.823 . . . . 0.0 109.752 -178.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 36.1 p . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -72.27 177.79 4.3 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.212 -0.93 . . . . 0.0 109.578 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.65 113.74 26.09 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-O 122.54 1.162 . . . . 0.0 110.102 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . 0.422 ' C ' ' H ' ' A' ' 344' ' ' ASP . 0.4 OUTLIER -104.5 -85.38 0.47 Allowed 'General case' 0 C--N 1.291 -1.964 0 N-CA-C 103.636 -2.727 . . . . 0.0 103.636 176.739 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.525 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 2.7 p -87.45 6.13 3.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 N-CA-C 104.296 -2.483 . . . . 0.0 104.296 173.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.525 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 6.4 t70 90.61 -178.55 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 113.502 -1.681 . . . . 0.0 110.336 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -107.82 163.91 12.71 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-O 121.542 0.687 . . . . 0.0 109.537 -179.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.47 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.6 t -130.03 -2.5 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -95.71 17.69 14.51 Favored 'General case' 0 C--N 1.279 -2.476 0 CA-C-O 122.849 1.309 . . . . 0.0 108.55 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -131.84 -9.79 3.5 Favored 'General case' 0 C--N 1.272 -2.78 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 177.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -75.92 -33.27 59.88 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.124 -1.398 . . . . 0.0 107.6 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.423 ' N ' HD23 ' A' ' 350' ' ' LEU . 1.6 pt? -68.4 -9.23 46.9 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 179.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.6 t -117.36 20.67 13.52 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -125.43 11.33 8.02 Favored 'General case' 0 C--N 1.279 -2.458 0 CA-C-O 123.315 1.531 . . . . 0.0 108.521 -177.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.592 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.257 4.5 tp -118.75 -61.97 1.59 Allowed 'General case' 0 C--N 1.258 -3.383 0 CA-C-N 113.019 -1.901 . . . . 0.0 106.083 -177.561 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.44 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 18.5 pt-20 -55.96 -32.31 63.76 Favored 'General case' 0 C--N 1.283 -2.309 0 CA-C-O 122.942 1.353 . . . . 0.0 108.851 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . 0.421 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.87 -27.8 31.56 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.675 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.446 -177.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . 0.405 ' H ' HG22 ' A' ' 356' ' ' THR . 3.4 t -113.05 -9.52 13.55 Favored 'General case' 0 C--N 1.267 -3.006 0 CA-C-N 113.721 -1.581 . . . . 0.0 111.503 -177.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.592 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.9 tp -109.18 -3.97 16.89 Favored 'General case' 0 C--N 1.289 -2.025 0 N-CA-C 105.774 -1.935 . . . . 0.0 105.774 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.284 -2.276 0 CA-C-N 113.029 -1.896 . . . . 0.0 110.071 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 60.1 m . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . 0.48 ' C ' ' H ' ' A' ' 342' ' ' GLU . 4.8 m-20 -74.83 -141.6 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.257 -0.902 . . . . 0.0 109.273 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . 0.47 ' O ' ' C ' ' A' ' 342' ' ' GLU . 10.4 mttp 70.54 -43.94 0.56 Allowed 'General case' 0 N--CA 1.485 1.287 0 CA-C-O 121.575 0.702 . . . . 0.0 110.713 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . 0.48 ' H ' ' C ' ' A' ' 340' ' ' ASP . 0.0 OUTLIER -33.57 -80.55 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.379 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.233 179.862 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.44 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 2.3 p -95.64 -3.08 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 178.059 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.44 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 3.6 t70 71.99 -174.66 0.17 Allowed 'General case' 0 C--N 1.285 -2.233 0 CA-C-O 122.207 1.003 . . . . 0.0 110.47 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -102.25 166.92 10.31 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.18 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 346' ' ' VAL . 5.4 t -114.29 -4.73 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -95.32 17.78 13.76 Favored 'General case' 0 C--N 1.279 -2.495 0 CA-C-O 122.828 1.299 . . . . 0.0 108.525 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -134.16 -8.34 2.64 Favored 'General case' 0 C--N 1.272 -2.762 0 N-CA-C 104.603 -2.369 . . . . 0.0 104.603 177.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -78.58 -33.47 47.61 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 114.044 -1.435 . . . . 0.0 107.461 178.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.439 ' N ' HD23 ' A' ' 350' ' ' LEU . 1.7 pt? -67.74 -8.84 38.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 29.2 t -116.76 21.18 13.56 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -128.56 9.02 5.95 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.34 1.543 . . . . 0.0 108.523 -177.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -118.85 -61.74 1.61 Allowed 'General case' 0 C--N 1.259 -3.347 0 CA-C-N 113.092 -1.867 . . . . 0.0 105.985 -177.634 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.438 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.0 pt-20 -56.55 -31.99 64.71 Favored 'General case' 0 C--N 1.283 -2.297 0 CA-C-O 122.889 1.328 . . . . 0.0 108.872 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . 0.41 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.3 tp -70.88 -27.48 30.44 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.642 0 CA-C-N 114.11 -1.405 . . . . 0.0 110.331 -178.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.5 t -113.63 -9.49 13.21 Favored 'General case' 0 C--N 1.268 -2.969 0 CA-C-N 113.777 -1.556 . . . . 0.0 111.755 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.9 tp -109.02 -3.74 17.2 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 105.677 -1.971 . . . . 0.0 105.677 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.404 ' O ' ' O ' ' A' ' 357' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.356 0 CA-C-N 113.114 -1.857 . . . . 0.0 110.037 179.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 54.2 p . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' A' ' 344' ' ' ASP . 0.9 OUTLIER -81.43 -1.19 44.8 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.224 -0.922 . . . . 0.0 109.441 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . 0.461 ' O ' ' C ' ' A' ' 342' ' ' GLU . 21.2 mttp -45.1 -44.29 10.33 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.895 0.855 . . . . 0.0 110.287 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . 0.461 ' C ' ' O ' ' A' ' 341' ' ' LYS . 0.4 OUTLIER -33.56 -79.65 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.252 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.494 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.427 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 3.8 p -87.72 -9.94 10.94 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.606 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.494 ' N ' ' O ' ' A' ' 340' ' ' ASP . 8.7 t70 69.95 -167.61 0.17 Allowed 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.486 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -131.3 22.55 4.8 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -179.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.428 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t -80.38 -4.07 6.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.783 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 178.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . 0.465 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 1.0 OUTLIER -94.67 12.74 26.64 Favored 'General case' 0 C--N 1.276 -2.614 0 CA-C-N 113.671 -1.604 . . . . 0.0 107.058 179.652 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -118.8 -11.43 9.78 Favored 'General case' 0 C--N 1.276 -2.627 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 178.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.98 -34.91 57.52 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.588 -1.187 . . . . 0.0 108.379 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.465 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -69.1 -9.75 54.21 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.0 t -113.44 19.67 16.73 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -126.15 12.65 7.72 Favored 'General case' 0 C--N 1.279 -2.465 0 CA-C-O 123.493 1.616 . . . . 0.0 108.067 -177.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.591 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.262 4.7 tp -117.99 -61.49 1.67 Allowed 'General case' 0 C--N 1.26 -3.307 0 CA-C-N 112.79 -2.005 . . . . 0.0 106.045 -177.569 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.433 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 12.2 pt-20 -55.76 -32.67 63.63 Favored 'General case' 0 C--N 1.283 -2.29 0 CA-C-O 122.943 1.354 . . . . 0.0 108.857 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . 0.425 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.74 -27.25 30.03 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.712 0 CA-C-N 113.967 -1.469 . . . . 0.0 110.436 -177.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -113.84 -9.06 13.13 Favored 'General case' 0 C--N 1.266 -3.035 0 CA-C-N 113.804 -1.543 . . . . 0.0 111.32 -177.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.591 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.7 tp -107.74 -4.89 17.71 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.405 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.281 -2.392 0 CA-C-N 113.008 -1.905 . . . . 0.0 109.901 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 26.7 t . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.331 0.586 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . 0.461 ' N ' ' OD1' ' A' ' 340' ' ' ASP . 21.7 p-10 -81.94 125.73 31.1 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.261 -0.899 . . . . 0.0 109.735 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . 0.544 ' O ' ' N ' ' A' ' 343' ' ' VAL . 0.0 OUTLIER 53.16 -166.77 0.07 Allowed 'General case' 0 C--N 1.304 -1.411 0 CA-C-O 121.526 0.679 . . . . 0.0 110.852 178.958 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 67.7 -65.51 0.24 Allowed 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 -178.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.544 ' N ' ' O ' ' A' ' 341' ' ' LYS . 0.3 OUTLIER -106.78 6.1 9.95 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.859 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 177.678 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.502 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 2.1 t70 79.49 -172.45 0.05 Allowed 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.771 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -107.15 166.95 10.24 Favored 'General case' 0 C--N 1.298 -1.65 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.654 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.469 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t -128.4 1.51 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 CA-C-O 122.784 1.278 . . . . 0.0 107.684 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . 0.451 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 2.3 t0 -88.25 14.35 9.58 Favored 'General case' 0 C--N 1.276 -2.605 0 CA-C-O 122.147 0.975 . . . . 0.0 109.076 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.69 -9.28 9.37 Favored 'General case' 0 C--N 1.274 -2.689 0 N-CA-C 105.692 -1.966 . . . . 0.0 105.692 178.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -78.2 -31.64 49.55 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.121 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.451 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -72.27 -9.82 58.98 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 22.9 t -113.52 17.63 18.2 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -121.07 15.03 11.52 Favored 'General case' 0 C--N 1.279 -2.475 0 CA-C-O 123.585 1.66 . . . . 0.0 107.844 -177.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.598 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.268 4.6 tp -117.19 -61.08 1.76 Allowed 'General case' 0 C--N 1.259 -3.332 0 CA-C-N 112.553 -2.112 . . . . 0.0 106.023 -177.538 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 355' ' ' ILE . 10.1 pt-20 -55.43 -33.8 63.89 Favored 'General case' 0 C--N 1.283 -2.304 0 CA-C-O 122.965 1.364 . . . . 0.0 108.791 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . 0.431 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 3.8 tp -69.49 -27.18 33.11 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.667 0 CA-C-N 114.013 -1.449 . . . . 0.0 110.535 -178.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -114.22 -8.7 12.92 Favored 'General case' 0 C--N 1.266 -3.057 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.404 -177.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.598 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.4 tp -107.26 -5.99 17.52 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.425 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.365 0 CA-C-N 113.115 -1.857 . . . . 0.0 109.983 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 39.0 m . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . 0.491 ' C ' ' H ' ' A' ' 342' ' ' GLU . 36.5 m-20 -159.35 177.36 11.08 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.217 -0.927 . . . . 0.0 109.565 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.57 -18.6 0.47 Allowed 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 122.018 0.913 . . . . 0.0 108.862 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . 0.491 ' H ' ' C ' ' A' ' 340' ' ' ASP . 0.0 OUTLIER -44.83 -77.83 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 178.969 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.599 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 6.4 p -83.31 -3.09 7.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 N-CA-C 108.42 -0.955 . . . . 0.0 108.42 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.599 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 16.5 t70 127.88 167.9 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.914 0 O-C-N 124.967 1.417 . . . . 0.0 109.829 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . 0.483 ' N ' ' CG ' ' A' ' 344' ' ' ASP . 25.3 mt-10 -99.73 162.97 12.68 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-O 121.768 0.794 . . . . 0.0 109.32 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.466 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 4.4 t -139.37 -1.47 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 CA-C-O 122.206 1.003 . . . . 0.0 108.568 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -94.76 17.42 13.58 Favored 'General case' 0 C--N 1.28 -2.438 0 CA-C-O 122.607 1.194 . . . . 0.0 108.789 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . 0.417 ' H ' ' H ' ' A' ' 349' ' ' ALA . . . -129.18 -10.8 4.71 Favored 'General case' 0 C--N 1.272 -2.802 0 N-CA-C 104.828 -2.286 . . . . 0.0 104.828 177.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . 0.417 ' H ' ' H ' ' A' ' 348' ' ' ALA . . . -75.76 -25.42 56.47 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 114.299 -1.319 . . . . 0.0 108.068 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -77.63 -11.38 59.86 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 30.1 t -112.75 9.2 19.09 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.421 -1.325 . . . . 0.0 107.421 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.261 47.1 t0 -107.36 8.85 29.88 Favored 'General case' 0 C--N 1.281 -2.372 0 CA-C-O 123.829 1.776 . . . . 0.0 107.577 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.445 HD23 ' N ' ' A' ' 354' ' ' GLU 0.319 0.0 OUTLIER -106.22 -56.55 2.17 Favored 'General case' 0 C--N 1.257 -3.417 0 CA-C-N 111.93 -2.396 . . . . 0.0 106.377 -177.654 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.472 ' CG ' ' N ' ' A' ' 355' ' ' ILE . 17.9 pt-20 -49.79 -32.29 13.63 Favored 'General case' 0 C--N 1.278 -2.542 0 CA-C-N 113.145 -1.843 . . . . 0.0 108.823 -178.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . 0.472 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -72.93 -17.27 18.08 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.307 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.666 -178.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 1.8 t -128.88 -12.98 4.7 Favored 'General case' 0 C--N 1.282 -2.351 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -173.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 357' ' ' LEU . 0.2 OUTLIER -95.59 15.71 19.15 Favored 'General case' 0 C--N 1.281 -2.385 0 N-CA-C 105.517 -2.031 . . . . 0.0 105.517 178.882 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.283 -2.287 0 CA-C-N 113.234 -1.803 . . . . 0.0 109.573 -178.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 42.6 m . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -159.4 -176.95 6.08 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.271 -0.893 . . . . 0.0 109.619 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . 0.535 ' O ' ' N ' ' A' ' 343' ' ' VAL . 1.9 mppt? -93.03 -162.3 0.92 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.469 -0.769 . . . . 0.0 109.1 -179.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . 0.502 ' C ' ' H ' ' A' ' 344' ' ' ASP . 1.5 mt-10 67.94 -64.52 0.28 Allowed 'General case' 0 C--N 1.308 -1.219 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.535 ' N ' ' O ' ' A' ' 341' ' ' LYS . 9.8 p -69.34 0.22 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.067 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.502 ' H ' ' C ' ' A' ' 342' ' ' GLU . 1.1 t70 179.97 174.01 0.92 Allowed 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.975 -179.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . 0.477 ' N ' ' CG ' ' A' ' 344' ' ' ASP . 31.9 mt-10 -142.6 159.9 41.34 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-O 121.572 0.701 . . . . 0.0 109.727 -179.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.473 ' O ' HG12 ' A' ' 346' ' ' VAL . 3.8 t -134.34 -0.65 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 CA-C-O 122.402 1.096 . . . . 0.0 108.258 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . 0.407 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.1 t70 -93.77 14.55 18.94 Favored 'General case' 0 C--N 1.278 -2.502 0 CA-C-O 122.481 1.134 . . . . 0.0 108.619 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -123.92 -10.04 7.72 Favored 'General case' 0 C--N 1.273 -2.725 0 N-CA-C 105.091 -2.189 . . . . 0.0 105.091 177.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.35 -31.66 58.2 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.474 -1.239 . . . . 0.0 108.091 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.407 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.4 pt? -71.26 -9.74 58.61 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 31.0 t -114.96 19.27 15.93 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -123.75 13.29 9.26 Favored 'General case' 0 C--N 1.279 -2.459 0 CA-C-O 123.481 1.61 . . . . 0.0 108.07 -177.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.571 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.264 4.2 tp -117.38 -60.08 1.87 Allowed 'General case' 0 C--N 1.259 -3.332 0 CA-C-N 112.773 -2.012 . . . . 0.0 106.105 -177.378 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.429 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.1 pt-20 -57.17 -32.67 66.67 Favored 'General case' 0 C--N 1.282 -2.332 0 CA-C-O 123.052 1.406 . . . . 0.0 108.865 179.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . 0.423 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.2 tp -70.99 -26.71 28.04 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.65 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.509 -177.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.3 t -113.26 -12.19 13.11 Favored 'General case' 0 C--N 1.266 -3.036 0 CA-C-N 113.826 -1.534 . . . . 0.0 111.461 -177.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.866 HD13 ' O ' ' A' ' 357' ' ' LEU . 2.6 tm? -100.37 -9.98 21.68 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 179.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.436 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.285 -2.205 0 CA-C-N 113.06 -1.882 . . . . 0.0 110.136 179.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 43.9 t . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . 0.467 ' O ' ' N ' ' A' ' 342' ' ' GLU . 0.5 OUTLIER -173.66 -35.08 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.262 -0.899 . . . . 0.0 109.366 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . 0.453 ' O ' ' C ' ' A' ' 342' ' ' GLU . 0.0 OUTLIER -45.36 -21.85 0.11 Allowed 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.798 0.809 . . . . 0.0 109.419 179.517 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . 0.467 ' N ' ' O ' ' A' ' 340' ' ' ASP . 6.8 mm-40 -35.49 -77.28 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.185 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.537 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.432 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 0.3 OUTLIER -99.27 -0.36 10.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 178.324 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.432 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 1.7 t70 69.34 -173.43 0.18 Allowed 'General case' 0 C--N 1.284 -2.264 0 CA-C-O 122.158 0.98 . . . . 0.0 110.404 179.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -68.2 175.97 2.97 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.455 ' O ' HG12 ' A' ' 346' ' ' VAL . 5.4 t -109.76 -5.91 11.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 178.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -99.54 16.2 24.08 Favored 'General case' 0 C--N 1.276 -2.594 0 CA-C-O 122.976 1.369 . . . . 0.0 107.789 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -128.46 -10.79 5.12 Favored 'General case' 0 C--N 1.272 -2.785 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 177.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -74.96 -32.63 61.75 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 114.319 -1.309 . . . . 0.0 107.99 178.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -70.21 -9.05 54.62 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.0 t -117.38 20.53 13.57 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -124.63 11.28 8.51 Favored 'General case' 0 C--N 1.28 -2.416 0 CA-C-O 123.376 1.56 . . . . 0.0 108.569 -177.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.578 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -119.45 -62.24 1.53 Allowed 'General case' 0 C--N 1.258 -3.39 0 CA-C-N 113.016 -1.902 . . . . 0.0 106.179 -177.372 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.44 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 11.2 pt-20 -55.99 -32.07 63.61 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-O 122.976 1.369 . . . . 0.0 108.894 179.338 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . 0.411 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.3 tp -70.98 -28.23 32.67 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.662 0 CA-C-N 113.999 -1.455 . . . . 0.0 110.375 -178.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . 0.418 ' H ' HG22 ' A' ' 356' ' ' THR . 3.5 t -112.88 -9.36 13.65 Favored 'General case' 0 C--N 1.267 -3.003 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.764 -176.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.578 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.0 tp -109.64 -3.34 16.91 Favored 'General case' 0 C--N 1.289 -2.027 0 N-CA-C 105.782 -1.933 . . . . 0.0 105.782 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.346 0 CA-C-N 113.093 -1.867 . . . . 0.0 110.032 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . 0.418 ' O ' ' OD1' ' A' ' 340' ' ' ASP . 38.3 t . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . 0.418 ' OD1' ' O ' ' A' ' 339' ' ' SER . 74.5 m-20 -149.58 -30.03 0.24 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.288 -0.882 . . . . 0.0 109.323 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . 0.613 ' O ' ' N ' ' A' ' 343' ' ' VAL . 7.5 mttp 62.1 -126.98 0.73 Allowed 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.47 -0.769 . . . . 0.0 110.734 179.518 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . 0.477 ' C ' ' H ' ' A' ' 344' ' ' ASP . 0.8 OUTLIER 59.55 -68.69 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 122.422 1.106 . . . . 0.0 108.899 -179.851 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.613 ' N ' ' O ' ' A' ' 341' ' ' LYS . 6.2 p -71.23 5.47 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.112 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.27 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.483 ' CG ' ' N ' ' A' ' 345' ' ' GLU . 5.9 t70 -177.43 174.66 1.55 Allowed 'General case' 0 C--N 1.283 -2.29 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.409 -179.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . 0.483 ' N ' ' CG ' ' A' ' 344' ' ' ASP . 29.7 mt-10 -131.9 166.54 21.41 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.474 0.654 . . . . 0.0 109.857 -178.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.46 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.2 t -103.37 -1.12 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 178.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -94.6 17.07 13.95 Favored 'General case' 0 C--N 1.278 -2.5 0 CA-C-O 122.621 1.201 . . . . 0.0 108.456 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -128.54 -9.27 5.12 Favored 'General case' 0 C--N 1.272 -2.78 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 177.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -78.35 -22.72 47.58 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 114.294 -1.321 . . . . 0.0 108.049 178.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -80.52 -11.19 59.7 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . 0.425 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 12.6 t -111.61 9.85 21.11 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.256 25.2 t0 -108.18 7.83 27.68 Favored 'General case' 0 C--N 1.281 -2.375 0 CA-C-O 123.891 1.805 . . . . 0.0 107.671 -179.335 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.907 HD23 ' N ' ' A' ' 354' ' ' GLU 0.318 0.5 OUTLIER -106.72 -53.41 2.62 Favored 'General case' 0 C--N 1.257 -3.43 0 CA-C-N 111.983 -2.372 . . . . 0.0 107.026 -177.676 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.907 ' N ' HD23 ' A' ' 353' ' ' LEU . 19.8 pt-20 -50.55 -34.76 26.75 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 113.563 -1.653 . . . . 0.0 108.635 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . 0.504 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.4 mt -70.62 -14.87 18.48 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.338 0 CA-C-N 113.664 -1.607 . . . . 0.0 110.304 -178.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.3 t -133.97 -4.36 2.8 Favored 'General case' 0 C--N 1.28 -2.426 0 C-N-CA 119.586 -0.846 . . . . 0.0 112.583 -174.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.527 ' N ' ' O ' ' A' ' 353' ' ' LEU . 9.8 tp -94.58 11.4 31.16 Favored 'General case' 0 C--N 1.284 -2.258 0 N-CA-C 104.563 -2.384 . . . . 0.0 104.563 177.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.449 ' OE1' ' N ' ' A' ' 358' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.286 -2.165 0 CA-C-N 112.96 -1.927 . . . . 0.0 109.698 -178.631 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . 0.506 ' CG ' ' H ' ' A' ' 341' ' ' LYS . 20.5 t0 -92.92 -166.13 1.47 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.22 -0.925 . . . . 0.0 109.762 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . 0.588 ' O ' ' N ' ' A' ' 343' ' ' VAL . 9.5 mptt -91.18 -151.4 0.26 Allowed 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.588 -0.695 . . . . 0.0 109.534 -179.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . 0.512 ' C ' ' H ' ' A' ' 344' ' ' ASP . 19.8 mm-40 63.32 -71.39 0.06 Allowed 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 -179.084 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.588 ' N ' ' O ' ' A' ' 341' ' ' LYS . 8.4 p -61.01 -5.96 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.023 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 177.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.512 ' H ' ' C ' ' A' ' 342' ' ' GLU . 7.0 t70 -179.63 169.57 1.34 Allowed 'General case' 0 C--N 1.288 -2.087 0 CA-C-O 121.916 0.865 . . . . 0.0 110.165 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . 0.49 ' O ' HG23 ' A' ' 346' ' ' VAL . 38.1 mt-10 -146.11 157.42 43.84 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.623 0.725 . . . . 0.0 109.558 -179.158 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 345' ' ' GLU . 41.4 t -156.09 -18.31 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 CA-C-O 122.092 0.949 . . . . 0.0 109.512 179.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . 0.45 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.0 t0 -93.58 16.11 14.5 Favored 'General case' 0 C--N 1.272 -2.775 0 CA-C-O 122.659 1.218 . . . . 0.0 108.094 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -121.87 -14.87 7.99 Favored 'General case' 0 C--N 1.272 -2.785 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 178.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -70.66 -28.15 64.57 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.494 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.45 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -78.51 -10.36 59.68 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . 0.42 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 43.5 t -113.5 10.77 18.24 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 179.526 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.254 34.8 t0 -107.82 7.57 28.27 Favored 'General case' 0 C--N 1.281 -2.374 0 CA-C-O 123.902 1.811 . . . . 0.0 107.662 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.921 HD23 ' N ' ' A' ' 354' ' ' GLU 0.321 0.4 OUTLIER -106.41 -54.0 2.54 Favored 'General case' 0 C--N 1.256 -3.473 0 CA-C-N 111.988 -2.369 . . . . 0.0 107.03 -177.471 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.921 ' N ' HD23 ' A' ' 353' ' ' LEU . 17.2 pt-20 -50.53 -34.48 25.55 Favored 'General case' 0 C--N 1.282 -2.33 0 CA-C-N 113.911 -1.495 . . . . 0.0 108.712 179.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . 0.504 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.6 mt -69.31 -16.06 20.26 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.355 0 CA-C-N 113.623 -1.626 . . . . 0.0 110.128 -178.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 1.9 t -132.12 -5.87 3.46 Favored 'General case' 0 C--N 1.283 -2.322 0 C-N-CA 119.683 -0.807 . . . . 0.0 112.737 -174.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.506 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.9 OUTLIER -97.91 10.55 39.97 Favored 'General case' 0 C--N 1.286 -2.187 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 177.911 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.276 -2.609 0 CA-C-N 112.671 -2.059 . . . . 0.0 109.545 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 38.4 m . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -163.74 -178.55 5.81 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.229 -0.919 . . . . 0.0 109.633 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . 0.541 ' CD ' ' N ' ' A' ' 341' ' ' LYS . 9.9 mptt -92.27 -161.86 0.87 Allowed 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.496 -0.753 . . . . 0.0 109.993 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 66.13 -66.38 0.17 Allowed 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 122.288 1.042 . . . . 0.0 108.773 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.534 ' N ' ' O ' ' A' ' 341' ' ' LYS . 6.4 p -86.53 -40.47 14.23 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.943 0 CA-C-O 122.243 1.021 . . . . 0.0 109.169 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.534 ' N ' ' CG1' ' A' ' 343' ' ' VAL . 15.0 t0 59.12 -174.58 0.1 Allowed 'General case' 0 C--N 1.27 -2.89 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.988 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -123.08 162.64 22.04 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-O 121.657 0.741 . . . . 0.0 109.588 -179.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.471 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.6 t -132.11 -0.7 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 CA-C-O 122.422 1.106 . . . . 0.0 108.183 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -93.35 14.67 17.7 Favored 'General case' 0 C--N 1.278 -2.517 0 CA-C-O 122.505 1.145 . . . . 0.0 108.595 179.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -125.03 -10.15 7.13 Favored 'General case' 0 C--N 1.273 -2.739 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 177.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.2 -31.35 58.39 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.414 -1.266 . . . . 0.0 108.065 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -71.57 -9.77 58.74 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 25.9 t -115.28 19.14 15.77 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -122.88 13.44 9.87 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-O 123.483 1.611 . . . . 0.0 108.258 -177.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.264 5.7 tp -118.55 -63.74 1.37 Allowed 'General case' 0 C--N 1.258 -3.378 0 CA-C-N 112.763 -2.017 . . . . 0.0 105.993 -177.554 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.442 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.0 pt-20 -53.74 -32.06 50.74 Favored 'General case' 0 C--N 1.283 -2.323 0 CA-C-O 123.029 1.395 . . . . 0.0 108.999 179.234 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . 0.412 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.1 tp -72.26 -25.63 23.61 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.663 0 CA-C-N 113.971 -1.468 . . . . 0.0 110.69 -177.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.3 t -114.96 -13.5 11.92 Favored 'General case' 0 C--N 1.267 -3.021 0 CA-C-N 114.074 -1.421 . . . . 0.0 112.513 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.7 OUTLIER -84.7 -31.14 24.25 Favored 'General case' 0 C--N 1.282 -2.357 0 N-CA-C 105.142 -2.17 . . . . 0.0 105.142 179.079 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? . . . . . 0 C--N 1.271 -2.836 0 CA-C-N 111.973 -2.376 . . . . 0.0 109.87 179.054 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 70.4 m . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . 0.525 ' C ' ' H ' ' A' ' 342' ' ' GLU . 4.8 m-20 51.01 -136.77 1.24 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.203 -0.936 . . . . 0.0 109.481 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' A' ' 342' ' ' GLU . 0.0 OUTLIER 74.26 -27.42 0.19 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.528 -0.732 . . . . 0.0 109.472 179.945 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . 0.525 ' H ' ' C ' ' A' ' 340' ' ' ASP . 0.0 OUTLIER -44.0 -82.94 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 178.756 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.47 ' O ' ' CB ' ' A' ' 344' ' ' ASP . 1.6 p -93.79 6.56 6.61 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.47 ' CB ' ' O ' ' A' ' 343' ' ' VAL . 6.7 t70 77.18 -179.04 0.13 Allowed 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.392 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -83.93 169.31 15.18 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-O 121.586 0.708 . . . . 0.0 109.619 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.463 ' O ' HG12 ' A' ' 346' ' ' VAL . 4.9 t -123.8 -3.87 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -97.42 18.24 15.73 Favored 'General case' 0 C--N 1.28 -2.416 0 CA-C-O 123.003 1.382 . . . . 0.0 108.205 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . 0.432 ' H ' ' H ' ' A' ' 349' ' ' ALA . . . -133.89 -11.08 2.66 Favored 'General case' 0 C--N 1.272 -2.795 0 N-CA-C 104.358 -2.46 . . . . 0.0 104.358 177.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . 0.432 ' H ' ' H ' ' A' ' 348' ' ' ALA . . . -74.38 -34.1 63.24 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 113.96 -1.473 . . . . 0.0 107.591 178.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.445 ' N ' HD23 ' A' ' 350' ' ' LEU . 1.7 pt? -67.7 -8.75 37.69 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 27.3 t -118.45 20.63 12.96 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 123.096 1.426 . . . . 0.0 107.198 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -125.11 8.66 7.98 Favored 'General case' 0 C--N 1.279 -2.496 0 CA-C-O 123.386 1.565 . . . . 0.0 108.146 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.557 HD23 ' N ' ' A' ' 354' ' ' GLU 0.288 0.1 OUTLIER -113.31 -60.19 1.92 Allowed 'General case' 0 C--N 1.258 -3.372 0 CA-C-N 112.785 -2.007 . . . . 0.0 105.953 -178.638 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.557 ' N ' HD23 ' A' ' 353' ' ' LEU . 23.4 pt-20 -54.15 -34.86 61.44 Favored 'General case' 0 C--N 1.276 -2.609 0 CA-C-N 114.026 -1.443 . . . . 0.0 109.253 -178.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . 0.433 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 6.3 tp -69.04 -26.8 33.1 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.591 0 CA-C-N 113.812 -1.54 . . . . 0.0 111.061 -177.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . 0.418 ' H ' HG22 ' A' ' 356' ' ' THR . 3.4 t -112.93 -15.52 12.86 Favored 'General case' 0 C--N 1.265 -3.067 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.197 -176.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.2 OUTLIER -100.36 -6.96 24.98 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 179.493 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.426 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.284 -2.266 0 CA-C-N 113.314 -1.766 . . . . 0.0 110.012 179.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 44.8 m . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 53.18 -167.89 0.06 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.224 -0.922 . . . . 0.0 109.55 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . 0.483 ' CD ' ' N ' ' A' ' 341' ' ' LYS . 10.5 mptt -95.0 130.07 41.82 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 122.67 1.224 . . . . 0.0 110.681 -179.031 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.37 -63.01 0.52 Allowed 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 105.612 -1.995 . . . . 0.0 105.612 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.464 ' CG1' ' N ' ' A' ' 344' ' ' ASP . 9.2 p -106.29 -32.48 2.66 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 177.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.464 ' N ' ' CG1' ' A' ' 343' ' ' VAL . 21.1 t70 53.53 -162.31 0.11 Allowed 'General case' 0 C--N 1.273 -2.727 0 CA-C-N 114.091 -1.413 . . . . 0.0 110.948 178.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . 0.438 ' H ' ' CG ' ' A' ' 344' ' ' ASP . 29.1 mt-10 49.65 27.57 2.24 Favored 'General case' 0 C--N 1.3 -1.544 0 C-N-CA 119.842 -0.743 . . . . 0.0 110.35 179.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.443 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t -81.11 -3.49 6.69 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.828 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 178.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . 0.462 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 0.6 OUTLIER -95.39 13.49 25.64 Favored 'General case' 0 C--N 1.275 -2.672 0 CA-C-N 113.879 -1.509 . . . . 0.0 107.441 179.9 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -121.17 -11.81 8.78 Favored 'General case' 0 C--N 1.274 -2.691 0 N-CA-C 105.234 -2.136 . . . . 0.0 105.234 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.15 -25.92 55.76 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.424 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.462 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -80.28 -10.51 59.76 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . 0.42 ' OG ' ' OE2' ' A' ' 354' ' ' GLU . 29.8 t -111.11 10.55 21.97 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.255 46.4 t0 -107.94 6.48 27.26 Favored 'General case' 0 C--N 1.281 -2.383 0 CA-C-O 123.875 1.797 . . . . 0.0 107.643 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.861 HD23 ' N ' ' A' ' 354' ' ' GLU 0.317 0.2 OUTLIER -105.95 -52.97 2.72 Favored 'General case' 0 C--N 1.258 -3.403 0 CA-C-N 112.011 -2.359 . . . . 0.0 106.891 -177.784 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.861 ' N ' HD23 ' A' ' 353' ' ' LEU . 18.6 pt-20 -51.3 -33.9 30.89 Favored 'General case' 0 C--N 1.283 -2.322 0 CA-C-N 113.661 -1.609 . . . . 0.0 108.556 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . 0.498 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.5 mt -70.31 -15.37 19.05 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.368 0 CA-C-N 113.5 -1.682 . . . . 0.0 110.111 -178.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.3 t -134.07 -4.74 2.74 Favored 'General case' 0 C--N 1.281 -2.374 0 C-N-CA 119.671 -0.811 . . . . 0.0 112.886 -174.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' A' ' 353' ' ' LEU . 10.4 tp -100.74 12.69 36.97 Favored 'General case' 0 C--N 1.284 -2.257 0 N-CA-C 104.783 -2.303 . . . . 0.0 104.783 177.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.446 ' OE1' ' N ' ' A' ' 358' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.286 -2.167 0 CA-C-N 112.954 -1.93 . . . . 0.0 109.567 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 71.7 m . . . . . 0 N--CA 1.488 1.473 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . 0.531 ' N ' ' OD1' ' A' ' 340' ' ' ASP . 0.5 OUTLIER -55.92 -179.08 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.27 -0.894 . . . . 0.0 109.304 -179.932 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 72.68 -9.67 1.05 Allowed 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 122.367 1.079 . . . . 0.0 108.618 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . 0.511 ' H ' ' C ' ' A' ' 340' ' ' ASP . 0.1 OUTLIER -44.15 -83.16 0.01 OUTLIER 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.746 179.714 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.646 HG13 ' O ' ' A' ' 343' ' ' VAL . 6.6 p -101.85 44.78 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 CA-C-O 122.368 1.08 . . . . 0.0 109.775 -179.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.456 ' OD1' ' N ' ' A' ' 345' ' ' GLU . 2.7 t70 -170.84 170.94 6.25 Favored 'General case' 0 C--N 1.276 -2.59 0 CA-C-O 122.251 1.024 . . . . 0.0 111.248 -178.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . 0.456 ' N ' ' OD1' ' A' ' 344' ' ' ASP . 19.9 mt-10 -144.39 159.63 42.4 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.238 -178.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.46 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 3.4 t -129.55 -2.99 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 179.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -97.35 16.53 19.8 Favored 'General case' 0 C--N 1.281 -2.388 0 CA-C-O 122.592 1.187 . . . . 0.0 108.576 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -127.56 -10.26 5.65 Favored 'General case' 0 C--N 1.272 -2.769 0 N-CA-C 105.043 -2.206 . . . . 0.0 105.043 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.94 -24.61 52.38 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 114.286 -1.325 . . . . 0.0 108.145 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -79.22 -11.13 59.96 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 39.5 t -111.93 8.7 20.42 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . 0.267 13.5 t70 -106.86 11.27 30.21 Favored 'General case' 0 C--N 1.282 -2.366 0 CA-C-O 123.691 1.71 . . . . 0.0 107.798 -179.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.48 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.307 0.0 OUTLIER -107.84 -58.91 1.91 Allowed 'General case' 0 C--N 1.257 -3.432 0 CA-C-N 112.112 -2.313 . . . . 0.0 106.3 -177.242 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.476 ' CG ' ' N ' ' A' ' 355' ' ' ILE . 16.1 pt-20 -47.93 -32.58 6.55 Favored 'General case' 0 C--N 1.281 -2.376 0 CA-C-N 113.223 -1.808 . . . . 0.0 108.978 -178.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . 0.476 ' N ' ' CG ' ' A' ' 354' ' ' GLU . 1.3 mt -73.34 -17.49 17.75 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.319 0 CA-C-N 113.622 -1.626 . . . . 0.0 110.658 -178.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 2.1 t -130.51 -11.11 4.02 Favored 'General case' 0 C--N 1.28 -2.415 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -173.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.48 ' N ' ' O ' ' A' ' 353' ' ' LEU . 0.2 OUTLIER -95.16 14.48 21.96 Favored 'General case' 0 C--N 1.281 -2.39 0 N-CA-C 105.44 -2.059 . . . . 0.0 105.44 178.85 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.285 -2.211 0 CA-C-N 113.135 -1.848 . . . . 0.0 109.617 -178.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 69.6 m . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 121.312 0.577 . . . . 0.0 109.547 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . 0.495 ' CG ' ' H ' ' A' ' 341' ' ' LYS . 22.4 t70 -167.15 -155.17 0.18 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.289 -0.882 . . . . 0.0 109.338 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . 0.495 ' H ' ' CG ' ' A' ' 340' ' ' ASP . 0.0 OUTLIER -124.6 -163.49 1.17 Allowed 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 -179.615 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 67.46 -62.94 0.31 Allowed 'General case' 0 C--N 1.304 -1.388 0 CA-C-O 122.17 0.986 . . . . 0.0 109.189 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.669 ' O ' HG22 ' A' ' 343' ' ' VAL . 4.8 p -121.63 50.17 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.037 0 CA-C-O 122.757 1.265 . . . . 0.0 109.723 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.443 ' OD1' ' N ' ' A' ' 345' ' ' GLU . 14.5 t0 -170.45 172.72 5.91 Favored 'General case' 0 C--N 1.274 -2.7 0 CA-C-N 114.262 -1.335 . . . . 0.0 110.68 -179.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . 0.443 ' N ' ' OD1' ' A' ' 344' ' ' ASP . 22.6 mt-10 48.48 20.92 0.34 Allowed 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 121.592 0.71 . . . . 0.0 109.89 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.413 ' N ' ' C ' ' A' ' 344' ' ' ASP . 3.7 t -83.94 -7.0 10.7 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 178.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . 0.462 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 3.0 t70 -96.68 13.85 26.95 Favored 'General case' 0 C--N 1.276 -2.618 0 CA-C-N 113.573 -1.648 . . . . 0.0 106.939 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -118.98 -13.72 9.42 Favored 'General case' 0 C--N 1.273 -2.726 0 N-CA-C 105.28 -2.118 . . . . 0.0 105.28 178.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -73.75 -35.21 65.0 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.53 -1.214 . . . . 0.0 108.554 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.462 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -69.36 -9.31 52.86 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 26.1 t -115.43 20.13 15.0 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -124.16 13.01 8.97 Favored 'General case' 0 C--N 1.28 -2.438 0 CA-C-O 123.39 1.567 . . . . 0.0 108.352 -177.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.577 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.5 tp -118.53 -61.67 1.63 Allowed 'General case' 0 C--N 1.258 -3.391 0 CA-C-N 112.876 -1.966 . . . . 0.0 106.101 -177.412 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.445 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.1 pt-20 -56.18 -32.75 64.64 Favored 'General case' 0 C--N 1.282 -2.331 0 CA-C-O 122.952 1.358 . . . . 0.0 108.856 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . 0.415 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.0 tp -70.67 -28.04 32.97 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.693 0 CA-C-N 113.995 -1.457 . . . . 0.0 110.515 -177.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . . . . . . . . . 3.4 t -112.51 -9.89 13.76 Favored 'General case' 0 C--N 1.265 -3.066 0 CA-C-N 113.743 -1.572 . . . . 0.0 111.404 -177.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.577 ' N ' ' O ' ' A' ' 353' ' ' LEU . 18.1 tp -107.82 -4.9 17.61 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.424 ' OXT' ' O ' ' A' ' 357' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.281 -2.377 0 CA-C-N 113.081 -1.872 . . . . 0.0 109.932 179.108 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 25.6 t . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 57.65 -140.98 0.78 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.281 -0.887 . . . . 0.0 109.814 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . 0.541 ' CD ' ' N ' ' A' ' 341' ' ' LYS . 10.3 mptt -86.4 120.25 27.54 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 123.104 1.431 . . . . 0.0 110.812 -178.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . 0.565 ' C ' ' H ' ' A' ' 344' ' ' ASP . 0.1 OUTLIER -124.22 -56.48 1.63 Allowed 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 106.191 -1.781 . . . . 0.0 106.191 179.9 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.628 ' O ' HG22 ' A' ' 343' ' ' VAL . 7.6 p -75.1 17.2 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-O 122.467 1.127 . . . . 0.0 109.097 178.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.565 ' H ' ' C ' ' A' ' 342' ' ' GLU . 5.1 t70 -160.41 -30.03 0.06 Allowed 'General case' 0 C--N 1.277 -2.571 0 C-N-CA 118.919 -1.112 . . . . 0.0 110.047 -178.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . 0.486 ' O ' ' O ' ' A' ' 344' ' ' ASP . 27.8 mt-10 53.7 150.56 0.0 OUTLIER 'General case' 0 C--N 1.276 -2.606 0 CA-C-O 122.243 1.02 . . . . 0.0 111.655 178.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.472 ' O ' ' CG1' ' A' ' 346' ' ' VAL . 2.5 t -145.03 -0.14 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 CA-C-O 122.323 1.059 . . . . 0.0 108.678 179.528 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 4.4 t70 -91.09 15.34 11.86 Favored 'General case' 0 C--N 1.279 -2.459 0 CA-C-O 122.251 1.024 . . . . 0.0 109.071 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.93 -10.91 9.02 Favored 'General case' 0 C--N 1.272 -2.782 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.56 -33.53 58.5 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.585 -1.189 . . . . 0.0 108.189 178.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.424 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.2 pt? -70.75 -9.67 57.82 Favored 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 27.1 t -114.45 19.53 16.11 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -123.42 13.42 9.49 Favored 'General case' 0 C--N 1.28 -2.455 0 CA-C-N 113.816 -1.538 . . . . 0.0 108.39 -177.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.541 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.26 4.3 tp -119.4 -61.86 1.57 Allowed 'General case' 0 C--N 1.26 -3.299 0 CA-C-N 113.041 -1.89 . . . . 0.0 106.252 -177.235 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.454 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.2 pt-20 -56.27 -29.24 60.86 Favored 'General case' 0 C--N 1.286 -2.175 0 CA-C-N 114.095 -1.412 . . . . 0.0 109.041 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . . . . . . . . . 4.0 tp -76.49 -22.57 15.29 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.685 0 CA-C-N 113.768 -1.56 . . . . 0.0 110.69 -177.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . 0.452 ' C ' ' H ' ' A' ' 358' ' ' GLU . 3.0 t -118.78 -11.86 9.73 Favored 'General case' 0 C--N 1.27 -2.879 0 CA-C-N 113.897 -1.501 . . . . 0.0 112.527 -176.499 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.541 ' N ' ' O ' ' A' ' 353' ' ' LEU . 7.7 tp -93.72 17.2 12.29 Favored 'General case' 0 C--N 1.286 -2.171 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 179.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.452 ' H ' ' C ' ' A' ' 356' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.283 -2.318 0 CA-C-N 113.123 -1.853 . . . . 0.0 109.667 -177.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 339' ' ' SER . . . . . . . . . . . . . 20.6 m . . . . . 0 N--CA 1.49 1.525 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 340' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -156.99 -36.16 0.08 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.22 -0.925 . . . . 0.0 109.548 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . 0.652 ' O ' ' N ' ' A' ' 343' ' ' VAL . 13.3 mttt 59.99 -129.29 1.04 Allowed 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.415 -0.803 . . . . 0.0 110.932 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 342' ' ' GLU . . . . . 0.454 ' C ' ' O ' ' A' ' 341' ' ' LYS . 0.0 OUTLIER 22.04 -76.58 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 122.045 0.926 . . . . 0.0 111.519 -179.84 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 343' ' ' VAL . . . . . 0.652 ' N ' ' O ' ' A' ' 341' ' ' LYS . 5.0 p -87.08 31.37 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.293 -1.87 0 CA-C-O 121.932 0.872 . . . . 0.0 110.29 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 344' ' ' ASP . . . . . 0.584 ' N ' ' O ' ' A' ' 341' ' ' LYS . 6.7 t70 -169.59 177.86 4.39 Favored 'General case' 0 C--N 1.283 -2.325 0 C-N-CA 118.769 -1.172 . . . . 0.0 110.981 -178.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 345' ' ' GLU . . . . . 0.484 ' N ' ' CG ' ' A' ' 344' ' ' ASP . 28.3 mt-10 58.82 147.32 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 121.85 0.833 . . . . 0.0 110.073 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 346' ' ' VAL . . . . . 0.472 ' O ' HG12 ' A' ' 346' ' ' VAL . 9.1 t -151.87 -3.68 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 CA-C-O 121.962 0.887 . . . . 0.0 109.782 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 347' ' ' ASP . . . . . 0.446 ' O ' ' CD2' ' A' ' 350' ' ' LEU . 4.8 t70 -92.26 14.88 15.02 Favored 'General case' 0 C--N 1.277 -2.573 0 CA-C-O 122.324 1.059 . . . . 0.0 108.767 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 348' ' ' ALA . . . . . . . . . . . . . . . -120.12 -11.0 9.31 Favored 'General case' 0 C--N 1.272 -2.768 0 N-CA-C 105.438 -2.06 . . . . 0.0 105.438 178.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 349' ' ' ALA . . . . . . . . . . . . . . . -76.27 -33.92 59.13 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 114.606 -1.179 . . . . 0.0 108.403 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 350' ' ' LEU . . . . . 0.446 ' CD2' ' O ' ' A' ' 347' ' ' ASP . 1.3 pt? -70.16 -8.97 54.01 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 351' ' ' SER . . . . . . . . . . . . . 32.6 t -115.57 20.28 14.81 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 352' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -124.64 11.68 8.53 Favored 'General case' 0 C--N 1.279 -2.472 0 CA-C-O 123.359 1.552 . . . . 0.0 108.558 -177.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 357' ' ' LEU 0.259 4.7 tp -119.51 -62.08 1.54 Allowed 'General case' 0 C--N 1.258 -3.381 0 CA-C-N 113.033 -1.894 . . . . 0.0 106.141 -177.492 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 354' ' ' GLU . . . . . 0.44 ' N ' ' HG ' ' A' ' 353' ' ' LEU . 10.3 pt-20 -56.11 -32.14 63.93 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 114.274 -1.33 . . . . 0.0 108.867 179.474 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 355' ' ' ILE . . . . . 0.415 ' N ' ' HG3' ' A' ' 354' ' ' GLU . 4.6 tp -71.29 -27.71 30.05 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.691 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.506 -177.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 356' ' ' THR . . . . . 0.401 HG22 ' H ' ' A' ' 356' ' ' THR . 3.6 t -112.97 -9.54 13.59 Favored 'General case' 0 C--N 1.266 -3.053 0 CA-C-N 113.754 -1.566 . . . . 0.0 111.542 -177.004 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 353' ' ' LEU . 17.5 tp -108.86 -3.77 17.37 Favored 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 105.701 -1.963 . . . . 0.0 105.701 179.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.4 ' HG3' ' H ' ' A' ' 358' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.33 0 CA-C-N 113.161 -1.836 . . . . 0.0 109.959 179.045 . . . . . . . . 2 2 . 1 stop_ save_