data_2l1l_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 2l1l _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 39.5 pt . . . . . 0 C--O 1.236 0.342 0 N-CA-C 113.024 0.75 . . . . 2.63 113.024 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 80.5 p -48.89 119.18 3.01 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.576 0.584 . . . . 1.82 112.576 174.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.82 1.43 67.84 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 120.913 -0.66 . . . . 0.0 114.476 -179.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.33 -7.63 41.25 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 117.659 0.73 . . . . 1.02 112.431 176.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 86.4 mtp -112.41 159.96 18.2 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.29 0.478 . . . . 2.72 112.29 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -69.67 134.24 48.46 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 109.146 -0.687 . . . . 3.51 109.146 174.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -41.71 -35.42 0.78 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.37 0.878 . . . . 2.66 113.37 -173.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -73.84 -41.89 61.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.584 -0.734 . . . . 2.44 112.07 -176.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -64.83 -40.11 94.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.158 0.504 . . . . 2.08 110.88 171.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -53.72 -48.58 69.46 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.303 -0.862 . . . . 1.92 111.205 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -54.85 -57.6 10.94 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 111.9 0.333 . . . . 3.15 111.9 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -56.63 -35.93 68.9 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.157 0.911 . . . . 4.26 111.086 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.507 ' O ' HG12 ' B' ' 520' ' ' VAL . 76.5 t80 -76.14 -45.56 33.01 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.104 -0.953 . . . . 2.37 110.504 -173.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 517' ' ' LEU . . . . . 0.533 ' HA ' HG21 ' B' ' 520' ' ' VAL . 8.5 tp -66.76 -32.23 73.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.731 -0.668 . . . . 2.46 112.591 177.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 518' ' ' VAL . . . . . . . . . . . . . 7.7 p -67.57 -35.07 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 118.483 -1.287 . . . . 2.02 109.021 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 42.8 m -72.9 -36.38 67.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.41 0.624 . . . . 1.82 112.444 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 520' ' ' VAL . . . . . 0.688 HG23 HG13 ' B' ' 521' ' ' ILE . 25.5 m -71.21 -42.3 75.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.395 -0.366 . . . . 1.86 111.636 -174.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 521' ' ' ILE . . . . . 0.688 HG13 HG23 ' B' ' 520' ' ' VAL . 82.4 mt -90.69 -25.86 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 N-CA-C 115.418 1.636 . . . . 2.46 115.418 -175.097 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -60.82 -35.16 75.81 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.717 -0.845 . . . . 2.99 108.717 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -92.4 -21.62 20.11 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.032 1.493 . . . . 2.17 115.032 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 524' ' ' LEU . . . . . 0.472 HD23 ' HB ' ' B' ' 544' ' ' ILE . 16.4 tp -70.53 -45.45 65.51 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 109.325 -0.621 . . . . 2.08 109.325 168.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 43.2 tp -52.15 -45.52 65.06 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-O 121.211 0.529 . . . . 2.48 110.953 169.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.46 -40.57 94.42 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 52.2 tp -63.53 -36.16 82.87 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.057 0.456 . . . . 2.2 111.483 175.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 49.9 t -63.47 -47.74 80.58 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.012 -0.54 . . . . 1.05 110.705 -175.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -61.68 -29.65 70.22 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.508 -0.769 . . . . 2.5 112.56 173.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -71.65 -54.71 9.49 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.369 0.877 . . . . 2.83 113.369 -177.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -68.76 137.99 54.49 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.98 -0.555 . . . . 2.73 111.031 -177.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -96.49 160.72 14.25 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.749 -0.66 . . . . 4.81 110.19 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.64 1.35 Allowed Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.912 -0.585 . . . . 0.0 114.031 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -47.18 -36.61 8.89 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 113.175 0.805 . . . . 3.36 113.175 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -50.53 -51.86 43.88 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.376 -0.53 . . . . 2.2 110.823 174.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -66.05 -44.85 83.37 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.62 0.6 . . . . 2.09 112.62 178.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 537' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -67.87 -31.95 72.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.93 110.272 -174.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.12 -46.96 69.45 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 115.815 -0.629 . . . . 1.02 111.149 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 74.4 mt -58.24 -54.9 26.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 2.34 111.218 173.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 540' ' ' ILE . . . . . . . . . . . . . 47.0 mm -56.73 -48.17 81.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 2.37 110.601 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 541' ' ' ALA . . . . . 0.412 ' O ' ' CG2' ' B' ' 544' ' ' ILE . . . -57.48 -43.98 84.54 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 113.599 0.963 . . . . 0.69 113.599 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 542' ' ' SER . . . . . 0.561 ' HA ' ' HE1' ' B' ' 545' ' ' MET . 92.5 p -60.54 -38.7 85.31 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.557 -0.457 . . . . 1.63 110.301 -178.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -69.1 -47.07 66.14 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 114.298 1.221 . . . . 2.41 114.298 -175.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 544' ' ' ILE . . . . . 0.472 ' HB ' HD23 ' B' ' 524' ' ' LEU . 7.8 tt -52.6 -45.92 48.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 108.52 -0.919 . . . . 2.23 108.52 170.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 545' ' ' MET . . . . . 0.577 ' HE1' ' HG2' ' B' ' 583' ' ' MET . 74.5 mtm -64.03 -42.33 97.13 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.744 -0.782 . . . . 3.06 112.766 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -58.39 -48.73 79.68 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 119.224 -0.991 . . . . 2.36 109.838 176.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 36.1 mm -55.05 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.794 0.664 . . . . 2.07 112.794 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 548' ' ' VAL . . . . . 0.591 HG22 HD12 ' B' ' 555' ' ' LEU . 9.3 p -47.36 -44.21 8.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 C-N-CA 119.77 -0.772 . . . . 2.03 111.488 176.245 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 549' ' ' GLY . . . . . 0.404 ' N ' HG13 ' B' ' 548' ' ' VAL . . . -57.4 -28.05 58.85 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.845 -0.534 . . . . 0.0 112.908 -177.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 550' ' ' GLN . . . . . 0.431 ' C ' ' HD3' ' B' ' 552' ' ' PRO . 16.1 mm100 -87.06 -9.56 55.14 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.617 0.599 . . . . 2.85 112.617 -175.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -120.39 59.67 7.01 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.807 1.04 . . . . 3.84 113.807 -177.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 552' ' ' PRO . . . . . 0.431 ' HD3' ' C ' ' B' ' 550' ' ' GLN . 34.4 Cg_exo -55.98 -39.34 91.81 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.068 0.509 . . . . 0.89 113.152 177.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -56.3 -46.65 79.72 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 121.164 0.507 . . . . 4.49 109.997 -174.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -49.02 -59.64 3.45 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 123.931 0.892 . . . . 1.05 112.158 167.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 555' ' ' LEU . . . . . 0.591 HD12 HG22 ' B' ' 548' ' ' VAL . 82.2 mt -54.41 -48.51 71.53 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 116.271 -0.422 . . . . 2.09 110.195 -179.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . 0.544 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 56.0 ttt180 -53.98 -35.82 62.24 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.833 1.049 . . . . 3.63 113.833 -178.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.05 -12.18 50.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.538 -0.465 . . . . 1.0 112.106 -177.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 51.0 m-70 -128.21 78.51 1.84 Allowed 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.393 1.257 . . . . 3.8 114.393 -177.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 5.6 m-90 -50.63 -48.22 58.15 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.492 2.034 . . . . 3.87 116.492 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -56.68 -36.56 69.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.423 . . . . 3.79 111.152 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 561' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -74.92 -45.12 44.7 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.126 -1.03 . . . . 1.8 111.882 175.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . 0.513 HD12 ' HB3' ' B' ' 555' ' ' LEU . 26.2 tp -50.01 -59.09 4.22 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 122.44 0.296 . . . . 1.94 110.314 175.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 563' ' ' LYS . . . . . 0.631 ' HZ3' ' HB3' ' B' ' 563' ' ' LYS . 8.4 mtpm? -50.24 -38.63 41.57 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.864 1.061 . . . . 3.16 113.864 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 89.9 m -71.73 -39.42 70.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.583 0.706 . . . . 1.88 110.413 -176.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 565' ' ' VAL . . . . . . . . . . . . . 59.3 t -62.81 -41.34 92.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 115.667 -0.697 . . . . 1.81 112.529 173.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 566' ' ' VAL . . . . . 0.449 HG22 ' O ' ' B' ' 562' ' ' LEU . 42.3 t -70.94 -50.82 40.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.49 -0.484 . . . . 2.0 110.873 -176.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -51.1 -37.48 46.12 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.075 -0.512 . . . . 2.53 111.978 170.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 25.5 mmtp -72.55 -32.73 66.31 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.723 -0.473 . . . . 3.93 109.723 -179.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 569' ' ' LEU . . . . . 0.406 ' O ' ' HG3' ' B' ' 573' ' ' MET . 57.1 mt -67.52 -36.43 81.02 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 108.66 -0.867 . . . . 2.53 108.66 177.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -65.4 -39.38 92.11 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.859 -0.423 . . . . 4.72 109.859 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -57.69 -53.53 57.13 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.881 -0.727 . . . . 2.47 110.483 176.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -62.39 -9.89 9.7 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.158 1.17 . . . . 1.87 114.158 -177.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 573' ' ' MET . . . . . 0.594 ' HB3' HD12 ' B' ' 625' ' ' LEU . 26.5 mtm -76.42 -5.29 46.69 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.671 0.748 . . . . 2.56 109.667 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -109.49 -0.59 18.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.765 -1.107 . . . . 4.11 111.395 173.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 575' ' ' GLU . . . . . 0.439 ' HG2' HG12 ' B' ' 580' ' ' VAL . 18.6 tp10 -68.46 130.26 42.36 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.233 -0.44 . . . . 1.57 110.188 177.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 10.2 t -87.88 -21.34 25.04 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 112.947 0.721 . . . . 2.01 112.947 -177.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -60.17 128.01 34.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.48 0.657 . . . . 3.71 112.516 -175.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -44.81 125.83 5.28 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.391 -0.822 . . . . 2.15 113.095 -171.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.62 4.83 Favored Glycine 0 C--O 1.223 -0.57 0 N-CA-C 116.294 1.278 . . . . 0.0 116.294 174.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 580' ' ' VAL . . . . . 0.439 HG12 ' HG2' ' B' ' 575' ' ' GLU . 43.1 t -53.88 -46.35 63.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 113.057 0.762 . . . . 1.89 113.057 -175.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.605 ' H ' ' NE2' ' B' ' 581' ' ' GLN . 0.1 OUTLIER -59.64 -42.25 92.34 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.409 0.522 . . . . 2.46 112.409 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -60.54 -42.45 96.54 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.159 0.429 . . . . 2.23 112.159 172.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 583' ' ' MET . . . . . 0.646 ' HE1' ' HA ' ' B' ' 583' ' ' MET . 3.1 tpt -60.7 -49.53 77.15 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 121.058 -0.257 . . . . 3.01 110.416 175.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.89 80.29 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.181 -0.463 . . . . 1.01 111.744 -177.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 81.2 m -74.44 -40.92 61.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 119.976 -0.69 . . . . 2.2 111.938 -177.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 586' ' ' ASP . . . . . 0.462 ' O ' HG22 ' B' ' 589' ' ' ILE . 2.0 m-20 -59.6 -46.32 89.3 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.273 -0.421 . . . . 1.98 111.974 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 87.2 m -62.16 -41.22 98.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.92 110.43 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 588' ' ' PHE . . . . . 0.5 ' O ' HG23 ' B' ' 591' ' ' ILE . 87.8 t80 -61.4 -32.22 72.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.047 -0.524 . . . . 0.72 111.232 -177.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 589' ' ' ILE . . . . . 0.462 HG22 ' O ' ' B' ' 586' ' ' ASP . 9.7 tp -79.91 -35.99 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.871 -1.932 . . . . 2.46 109.74 -175.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . 0.418 ' N ' HG21 ' B' ' 589' ' ' ILE . 61.2 mttp -57.41 -50.04 74.3 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 107.752 -1.203 . . . . 3.09 107.752 176.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . 0.5 HG23 ' O ' ' B' ' 588' ' ' PHE . 12.2 tt -63.75 -43.72 98.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 112.885 0.698 . . . . 2.43 112.885 -177.062 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . 0.427 ' N ' HG22 ' B' ' 591' ' ' ILE . . . -63.94 -39.12 93.42 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.407 -0.517 . . . . 1.01 112.275 177.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -62.32 -70.08 0.22 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 119.113 -1.035 . . . . 2.88 109.848 174.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 594' ' ' LYS . . . . . 0.463 ' HD2' ' N ' ' B' ' 594' ' ' LYS . 13.5 mptt -56.15 -23.76 36.82 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 116.56 2.059 . . . . 2.67 116.56 -176.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.1 p -121.76 25.29 9.31 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.222 1.193 . . . . 1.97 114.222 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -48.61 -38.45 20.92 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.838 1.792 . . . . 4.07 115.838 -172.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 38.7 mmt180 -69.56 -32.61 71.5 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.202 0.816 . . . . 4.32 113.202 -175.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 598' ' ' HIS . . . . . 0.544 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 89.4 m-70 -70.21 -3.81 18.68 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.588 -0.733 . . . . 2.88 112.052 -173.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 599' ' ' PHE . . . . . 0.55 ' HB3' HG22 ' B' ' 611' ' ' ILE . 8.7 m-85 -105.64 -16.81 14.59 Favored 'General case' 0 CA--C 1.517 -0.301 0 O-C-N 123.621 0.576 . . . . 3.7 110.204 -176.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 600' ' ' VAL . . . . . 0.4 HG12 HD11 ' B' ' 611' ' ' ILE . 34.5 m -105.85 -24.37 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 115.084 -0.962 . . . . 2.05 111.355 -175.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -102.0 139.46 37.6 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 119.504 -0.879 . . . . 2.81 111.661 176.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 4.8 p -60.86 122.81 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 N-CA-C 108.639 -0.874 . . . . 1.99 108.639 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 603' ' ' GLN . . . . . 0.414 HE21 ' HB2' ' B' ' 603' ' ' GLN . 0.0 OUTLIER -92.88 167.33 11.91 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 123.645 0.591 . . . . 3.39 110.049 -177.589 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 30.8 t -71.91 128.81 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 113.022 0.749 . . . . 1.91 113.022 -175.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.46 6.57 64.2 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.062 -175.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 606' ' ' GLU . . . . . 0.54 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.0 tp10 -131.45 158.08 41.79 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.626 -0.83 . . . . 2.51 110.772 175.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 40.3 t -103.34 -22.57 4.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.04 -0.982 . . . . 2.03 112.527 -175.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 608' ' ' MET . . . . . 0.54 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 22.7 ptp -136.92 142.25 37.88 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.611 0.597 . . . . 3.15 112.611 -174.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.11 130.9 37.05 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.889 1.06 . . . . 0.85 112.085 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 610' ' ' PHE . . . . . 0.421 ' O ' HG12 ' B' ' 614' ' ' ILE . 16.4 t80 -57.04 -31.8 65.54 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.794 0.294 . . . . 3.05 111.794 -174.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 611' ' ' ILE . . . . . 0.55 HG22 ' HB3' ' B' ' 599' ' ' PHE . 8.9 pt -50.14 -44.71 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 120.811 0.339 . . . . 2.38 110.591 178.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -49.93 -52.05 36.32 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.666 0.786 . . . . 2.15 112.844 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -59.91 -37.09 78.45 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.562 -0.455 . . . . 2.66 110.241 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 614' ' ' ILE . . . . . 0.421 HG12 ' O ' ' B' ' 610' ' ' PHE . 24.5 mm -64.51 -47.97 86.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.934 0 C-N-CA 120.118 -0.633 . . . . 2.28 112.013 178.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 9.9 tt -62.69 -31.08 71.92 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.978 0.733 . . . . 2.38 112.978 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -79.54 2.12 23.36 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.621 1.341 . . . . 2.62 114.621 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 617' ' ' ASN . . . . . 0.609 ' C ' HD21 ' B' ' 617' ' ' ASN . 0.2 OUTLIER -142.44 15.68 2.02 Favored 'General case' 0 C--O 1.242 0.685 0 N-CA-C 113.138 0.792 . . . . 2.63 113.138 -174.235 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 618' ' ' ILE . . . . . 0.464 ' O ' HG12 ' B' ' 621' ' ' ILE . 10.5 tt -46.97 -46.99 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 C-N-CA 118.921 -1.112 . . . . 2.47 110.17 -176.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 619' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -63.2 -51.05 67.88 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 113.785 1.031 . . . . 2.98 113.785 -176.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 620' ' ' THR . . . . . 0.418 ' HG1' ' HB2' ' B' ' 617' ' ' ASN . 48.5 p -56.97 -31.83 65.42 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 119.432 -0.907 . . . . 1.94 110.708 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 621' ' ' ILE . . . . . 0.464 HG12 ' O ' ' B' ' 618' ' ' ILE . 27.7 pt -79.3 -42.68 23.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.282 1.586 . . . . 2.57 115.282 -178.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 622' ' ' ILE . . . . . 0.463 HG22 HG13 ' B' ' 621' ' ' ILE . 2.8 pp -87.72 -6.21 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 115.035 1.494 . . . . 2.61 115.035 -177.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 18.9 p -20.03 -58.34 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 116.493 2.035 . . . . 2.06 116.493 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.23 -7.58 26.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.011 -1.45 . . . . 2.07 111.022 -163.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 625' ' ' LEU . . . . . 0.594 HD12 ' HB3' ' B' ' 573' ' ' MET . 9.1 mp -71.83 146.9 47.69 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 123.3 0.375 . . . . 2.24 111.662 -173.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 626' ' ' GLN . . . . . 0.408 ' O ' HG22 ' B' ' 630' ' ' VAL . 1.8 mp0 -76.85 162.1 71.45 Favored Pre-proline 0 N--CA 1.464 0.254 0 N-CA-C 108.794 -0.817 . . . . 2.99 108.794 174.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -47.78 -43.67 28.48 Favored 'Trans proline' 0 C--O 1.233 0.256 0 N-CA-C 115.799 1.423 . . . . 0.86 115.799 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -67.24 -43.03 82.97 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.423 -0.511 . . . . 3.24 109.66 -174.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 629' ' ' GLN . . . . . 0.409 HE22 ' HB3' ' B' ' 581' ' ' GLN . 27.5 mt-30 -63.27 -38.34 90.78 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 115.98 -0.555 . . . . 2.79 110.923 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 630' ' ' VAL . . . . . 0.408 HG22 ' O ' ' B' ' 626' ' ' GLN . 97.8 t . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.163 -0.922 . . . . 1.93 110.722 176.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 504' ' ' ILE . . . . . 0.67 HD13 ' H2 ' ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.236 0.386 0 N-CA-C 113.063 0.764 . . . . 2.63 113.063 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 505' ' ' SER . . . . . 0.444 ' HB3' ' HG3' ' B' ' 550' ' ' GLN . 79.8 p -48.85 119.11 2.95 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.549 0.574 . . . . 1.82 112.549 174.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.88 1.43 67.69 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.964 -0.636 . . . . 0.0 114.407 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.55 41.43 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.646 0.723 . . . . 1.02 112.443 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 54.6 mtt -112.42 160.01 18.16 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 112.32 0.489 . . . . 2.72 112.32 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -69.78 134.21 48.3 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.131 -0.692 . . . . 3.51 109.131 174.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -41.72 -35.44 0.79 Allowed 'General case' 0 C--O 1.241 0.623 0 N-CA-C 113.361 0.874 . . . . 2.66 113.361 -173.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -73.67 -41.98 61.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.546 -0.752 . . . . 2.44 112.152 -176.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -64.83 -40.11 94.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.145 0.498 . . . . 2.08 110.885 171.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 513' ' ' GLU . . . . . 0.5 ' HG3' HD22 ' B' ' 517' ' ' LEU . 9.1 tp10 -53.71 -48.66 69.36 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.365 -0.834 . . . . 1.92 111.108 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 514' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' B' ' 517' ' ' LEU . 62.9 mttp -54.81 -57.57 11.05 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 111.918 0.34 . . . . 3.15 111.918 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -56.61 -36.0 68.93 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 124.201 0.938 . . . . 4.26 111.092 -177.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.447 ' O ' HG21 ' B' ' 520' ' ' VAL . 88.8 t80 -76.02 -45.64 33.45 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.06 -0.973 . . . . 2.37 110.554 -173.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 517' ' ' LEU . . . . . 0.555 HD11 ' N ' ' B' ' 518' ' ' VAL . 4.4 pp -66.63 -32.26 73.47 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.708 -0.678 . . . . 2.46 112.674 177.087 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 518' ' ' VAL . . . . . 0.555 ' N ' HD11 ' B' ' 517' ' ' LEU . 7.7 p -67.53 -35.09 72.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 118.483 -1.287 . . . . 2.02 109.047 178.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 60.8 p -73.01 -36.33 66.99 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.82 112.391 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 520' ' ' VAL . . . . . 0.447 HG21 ' O ' ' B' ' 516' ' ' PHE . 56.0 t -71.23 -42.37 75.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.46 -0.336 . . . . 1.86 111.611 -174.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 521' ' ' ILE . . . . . 0.419 HG21 ' O ' ' B' ' 517' ' ' LEU . 14.5 tt -90.64 -25.75 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.492 1.664 . . . . 2.46 115.492 -175.116 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -60.83 -35.28 76.15 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.683 -0.858 . . . . 2.99 108.683 173.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -92.36 -21.5 20.21 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.02 1.489 . . . . 2.17 115.02 -177.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 84.2 mt -70.58 -45.46 65.34 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 109.28 -0.637 . . . . 2.08 109.28 168.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 84.6 mt -52.18 -45.46 65.15 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-O 121.329 0.585 . . . . 2.48 110.97 169.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.5 -40.59 94.34 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 -178.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 67.2 mt -63.57 -36.07 82.6 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 2.2 111.47 175.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 47.6 t -63.55 -47.73 80.37 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.08 -0.509 . . . . 1.05 110.661 -175.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -61.71 -29.59 70.2 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.508 -0.769 . . . . 2.5 112.589 173.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -71.61 -54.84 9.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.322 0.86 . . . . 2.83 113.322 -177.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 531' ' ' LYS . . . . . 0.441 ' O ' ' HD3' ' B' ' 537' ' ' LYS . 31.6 mmmt -68.71 137.87 54.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.994 -0.548 . . . . 2.73 111.047 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 19.1 ptt180 -96.37 160.67 14.29 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.79 -0.641 . . . . 4.81 110.149 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.39 119.58 1.34 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.841 -0.618 . . . . 0.0 114.008 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -47.06 -36.63 8.32 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.248 0.832 . . . . 3.36 113.248 177.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -50.53 -51.89 43.68 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.397 -0.521 . . . . 2.2 110.824 174.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 536' ' ' ASN . . . . . 0.424 ' O ' ' CG1' ' B' ' 539' ' ' ILE . 32.0 m-80 -65.98 -44.86 83.64 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.697 0.628 . . . . 2.09 112.697 178.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 537' ' ' LYS . . . . . 0.464 ' O ' ' HB3' ' B' ' 541' ' ' ALA . 5.3 mmmm -67.84 -32.02 72.26 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.93 110.263 -174.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.03 -47.04 69.52 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 115.889 -0.596 . . . . 1.02 111.156 178.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 539' ' ' ILE . . . . . 0.454 HG13 ' N ' ' B' ' 540' ' ' ILE . 43.5 pt -58.15 -54.93 25.79 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 2.34 111.224 173.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 540' ' ' ILE . . . . . 0.454 ' N ' HG13 ' B' ' 539' ' ' ILE . 87.1 mt -56.85 -48.09 81.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 121.7 -0.625 . . . . 2.37 110.57 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 541' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' B' ' 537' ' ' LYS . . . -57.35 -44.17 84.1 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 113.678 0.992 . . . . 0.69 113.678 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 95.8 p -60.33 -38.83 84.97 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 120.658 -0.417 . . . . 1.63 110.294 -178.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -69.0 -47.12 66.28 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.339 1.237 . . . . 2.41 114.339 -175.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 544' ' ' ILE . . . . . 0.509 HG13 ' N ' ' B' ' 545' ' ' MET . 47.1 pt -52.69 -45.89 49.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.515 -0.921 . . . . 2.23 108.515 170.075 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 545' ' ' MET . . . . . 0.67 ' HB3' HG23 ' B' ' 587' ' ' THR . 77.0 mtm -64.06 -42.34 97.04 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.761 -0.776 . . . . 3.06 112.786 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -58.26 -48.82 79.23 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 119.279 -0.969 . . . . 2.36 109.857 176.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 28.9 mm -55.04 -61.41 1.05 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 112.862 0.69 . . . . 2.07 112.862 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 548' ' ' VAL . . . . . 0.409 HG22 ' HA ' ' B' ' 545' ' ' MET . 33.4 m -47.32 -44.18 8.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 C-N-CA 119.872 -0.731 . . . . 2.03 111.498 176.169 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.53 -27.95 59.07 Favored Glycine 0 C--N 1.331 0.285 0 O-C-N 121.835 -0.541 . . . . 0.0 112.851 -177.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 550' ' ' GLN . . . . . 0.444 ' HG3' ' HB3' ' B' ' 505' ' ' SER . 21.8 tp60 -87.13 -9.52 55.09 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.613 0.598 . . . . 2.85 112.613 -175.346 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 551' ' ' TYR . . . . . 0.4 ' O ' HD21 ' B' ' 555' ' ' LEU . 74.3 m-85 -120.36 59.72 6.98 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.809 1.04 . . . . 3.84 113.809 -177.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.01 -39.3 92.03 Favored 'Trans proline' 0 CA--C 1.53 0.298 0 O-C-N 122.127 0.54 . . . . 0.89 113.143 177.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 15.5 ptp180 -56.35 -46.71 79.84 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 121.095 0.474 . . . . 4.49 109.931 -174.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -48.89 -59.8 3.28 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 123.958 0.903 . . . . 1.05 112.113 167.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 555' ' ' LEU . . . . . 0.607 HD13 ' HA ' ' B' ' 562' ' ' LEU . 4.4 mm? -54.34 -48.51 71.33 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 116.242 -0.436 . . . . 2.09 110.236 -178.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 63.1 mtp180 -53.93 -35.79 62.09 Favored 'General case' 0 C--O 1.243 0.757 0 N-CA-C 113.828 1.047 . . . . 3.63 113.828 -178.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.13 -12.14 50.74 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.486 -0.486 . . . . 1.0 112.058 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -128.27 78.51 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.399 1.259 . . . . 3.8 114.399 -177.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 559' ' ' TRP . . . . . 0.492 ' O ' ' HG2' ' B' ' 563' ' ' LYS . 31.8 m-90 -50.46 -48.32 56.56 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 116.563 2.06 . . . . 3.87 116.563 -176.088 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -56.67 -36.6 69.77 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.314 -0.403 . . . . 3.79 111.13 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 561' ' ' PHE . . . . . 0.416 ' O ' HG22 ' B' ' 565' ' ' VAL . 2.6 t80 -74.94 -45.08 44.83 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 119.087 -1.045 . . . . 1.8 111.847 175.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . 0.607 ' HA ' HD13 ' B' ' 555' ' ' LEU . 2.1 tt -50.0 -59.11 4.2 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.466 0.306 . . . . 1.94 110.29 175.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 563' ' ' LYS . . . . . 0.636 ' HG3' HE22 ' B' ' 603' ' ' GLN . 11.0 mmpt? -50.22 -38.67 41.48 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.863 1.061 . . . . 3.16 113.863 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 24.0 p -71.79 -39.33 69.98 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.495 0.664 . . . . 1.88 110.408 -176.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 565' ' ' VAL . . . . . 0.416 HG22 ' O ' ' B' ' 561' ' ' PHE . 97.9 t -62.83 -41.32 92.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.617 -0.72 . . . . 1.81 112.502 173.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 566' ' ' VAL . . . . . 0.517 HG13 ' N ' ' B' ' 567' ' ' ASN . 11.5 p -71.06 -50.74 40.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 C-N-CA 120.451 -0.499 . . . . 2.0 110.872 -176.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 567' ' ' ASN . . . . . 0.517 ' N ' HG13 ' B' ' 566' ' ' VAL . 6.7 t30 -51.13 -37.42 45.97 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.067 -0.515 . . . . 2.53 112.006 170.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 568' ' ' LYS . . . . . 0.564 ' HE2' ' HA ' ' B' ' 568' ' ' LYS . 0.3 OUTLIER -72.6 -32.7 66.17 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.746 -0.465 . . . . 3.93 109.746 -179.234 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 569' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' B' ' 573' ' ' MET . 4.1 mp -67.43 -36.52 81.39 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.67 -0.863 . . . . 2.53 108.67 177.103 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -65.38 -39.28 92.06 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.907 -0.405 . . . . 4.72 109.907 178.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.73 -53.47 57.79 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 119.921 -0.711 . . . . 2.47 110.51 176.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -62.49 -9.92 10.11 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.056 1.132 . . . . 1.87 114.056 -177.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 573' ' ' MET . . . . . 0.653 ' HB3' HD12 ' B' ' 625' ' ' LEU . 67.7 mtt -76.42 -5.31 46.75 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.618 0.723 . . . . 2.56 109.625 178.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 30.0 m-70 -109.42 -0.51 18.91 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.842 -1.072 . . . . 4.11 111.502 173.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 575' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -68.55 130.26 42.35 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.15 -0.477 . . . . 1.57 110.137 177.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 81.8 p -87.89 -21.27 25.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 112.981 0.734 . . . . 2.01 112.981 -177.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -60.2 128.01 34.67 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.411 0.624 . . . . 3.71 112.578 -175.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -44.9 125.88 5.4 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.388 -0.824 . . . . 2.15 113.103 -171.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.22 -34.64 4.82 Favored Glycine 0 C--O 1.223 -0.553 0 N-CA-C 116.242 1.257 . . . . 0.0 116.242 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 93.9 t -53.81 -46.27 63.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.232 0.827 . . . . 1.89 113.232 -175.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -59.77 -42.18 92.76 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.361 0.504 . . . . 2.46 112.361 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -60.56 -42.39 96.5 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.209 0.448 . . . . 2.23 112.209 172.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 26.4 mmt -60.76 -49.46 77.42 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 121.043 -0.263 . . . . 3.01 110.402 175.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.92 80.2 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.265 -0.425 . . . . 1.01 111.783 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 585' ' ' CYS . . . . . 0.416 ' O ' HG13 ' B' ' 589' ' ' ILE . 28.8 p -74.39 -40.98 61.7 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 120.066 -0.654 . . . . 2.2 111.929 -177.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -59.56 -46.35 89.16 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.209 -0.45 . . . . 1.98 111.962 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 587' ' ' THR . . . . . 0.67 HG23 ' HB3' ' B' ' 545' ' ' MET . 29.3 p -62.19 -41.23 98.14 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.298 0.639 . . . . 1.92 110.42 175.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -61.4 -32.25 72.18 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.059 -0.519 . . . . 0.72 111.177 -177.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 589' ' ' ILE . . . . . 0.416 HG13 ' O ' ' B' ' 585' ' ' CYS . 74.4 mt -79.81 -35.97 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 C-N-CA 116.91 -1.916 . . . . 2.46 109.831 -175.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -57.48 -49.99 74.49 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 107.717 -1.216 . . . . 3.09 107.717 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . 0.409 ' O ' ' SG ' ' B' ' 595' ' ' CYS . 49.0 mm -63.86 -43.71 97.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.697 -0.683 . . . . 2.43 112.779 -176.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.96 -39.13 93.44 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.512 -0.475 . . . . 1.01 112.252 177.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -62.34 -70.12 0.22 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 119.129 -1.029 . . . . 2.88 109.825 174.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -56.19 -23.65 36.62 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 116.617 2.08 . . . . 2.67 116.617 -176.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 595' ' ' CYS . . . . . 0.409 ' SG ' ' O ' ' B' ' 591' ' ' ILE . 1.4 p -121.79 25.29 9.29 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.189 1.181 . . . . 1.97 114.189 -178.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -48.54 -38.58 20.84 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 115.841 1.793 . . . . 4.07 115.841 -172.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -69.47 -32.64 71.68 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.302 0.852 . . . . 4.32 113.302 -175.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -70.19 -3.78 18.48 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.523 -0.762 . . . . 2.88 112.032 -173.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -105.6 -16.87 14.58 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.633 0.583 . . . . 3.7 110.197 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 600' ' ' VAL . . . . . 0.431 HG23 ' HG2' ' B' ' 601' ' ' GLN . 33.2 m -105.82 -24.39 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.037 -0.983 . . . . 2.05 111.327 -175.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 601' ' ' GLN . . . . . 0.431 ' HG2' HG23 ' B' ' 600' ' ' VAL . 14.2 mm100 -101.98 139.49 37.54 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.535 -0.866 . . . . 2.81 111.635 176.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 43.9 t -60.87 122.76 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 108.561 -0.903 . . . . 1.99 108.561 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 603' ' ' GLN . . . . . 0.636 HE22 ' HG3' ' B' ' 563' ' ' LYS . 11.5 pt20 -92.8 167.33 11.93 Favored 'General case' 0 C--O 1.224 -0.263 0 O-C-N 123.673 0.608 . . . . 3.39 110.116 -177.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 15.6 m -72.0 128.97 35.51 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 N-CA-C 112.98 0.733 . . . . 1.91 112.98 -175.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.33 6.57 64.43 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.11 -175.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 606' ' ' GLU . . . . . 0.541 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.3 tp10 -131.48 158.06 41.88 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.641 -0.824 . . . . 2.51 110.757 175.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 5.3 t -103.32 -22.58 4.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.036 -0.984 . . . . 2.03 112.472 -175.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 608' ' ' MET . . . . . 0.541 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 20.0 ptm -136.97 142.1 37.22 Favored Pre-proline 0 C--O 1.223 -0.297 0 N-CA-C 112.712 0.634 . . . . 3.15 112.712 -174.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 609' ' ' PRO . . . . . 0.527 ' HB2' HG21 ' B' ' 611' ' ' ILE . 9.6 Cg_endo -51.91 130.8 35.92 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 120.902 1.068 . . . . 0.85 112.202 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -57.0 -31.74 65.39 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.794 0.294 . . . . 3.05 111.794 -174.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 611' ' ' ILE . . . . . 0.527 HG21 ' HB2' ' B' ' 609' ' ' PRO . 12.2 tt -50.16 -44.74 23.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 CA-C-O 120.782 0.325 . . . . 2.38 110.493 178.287 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 612' ' ' ASP . . . . . 0.408 ' OD1' ' HG2' ' B' ' 609' ' ' PRO . 1.0 OUTLIER -50.04 -51.99 37.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.587 0.755 . . . . 2.15 112.849 177.72 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -59.88 -37.1 78.41 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.604 -0.438 . . . . 2.66 110.21 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 614' ' ' ILE . . . . . 0.439 ' O ' ' ND2' ' B' ' 617' ' ' ASN . 67.5 mt -64.6 -47.93 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 120.233 -0.587 . . . . 2.28 111.963 178.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 51.7 tp -62.66 -31.19 72.01 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.946 0.721 . . . . 2.38 112.946 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -79.47 2.12 23.14 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.632 1.345 . . . . 2.62 114.632 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 617' ' ' ASN . . . . . 0.46 ' C ' ' ND2' ' B' ' 617' ' ' ASN . 0.0 OUTLIER -142.47 15.79 2.01 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 113.141 0.793 . . . . 2.63 113.141 -174.248 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 618' ' ' ILE . . . . . 0.47 HG13 ' N ' ' B' ' 619' ' ' ASN . 19.7 pt -46.99 -47.06 8.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 C-N-CA 118.949 -1.1 . . . . 2.47 110.139 -176.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 619' ' ' ASN . . . . . 0.47 ' N ' HG13 ' B' ' 618' ' ' ILE . 3.3 p-10 -63.21 -51.05 67.85 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.769 1.026 . . . . 2.98 113.769 -176.355 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 620' ' ' THR . . . . . 0.402 HG21 ' ND2' ' B' ' 619' ' ' ASN . 62.9 p -56.89 -31.86 65.29 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 119.539 -0.864 . . . . 1.94 110.774 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 621' ' ' ILE . . . . . 0.46 HG13 HG21 ' B' ' 622' ' ' ILE . 49.2 pt -79.36 -42.6 23.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 115.385 1.624 . . . . 2.57 115.385 -179.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 622' ' ' ILE . . . . . 0.46 HG21 HG13 ' B' ' 621' ' ' ILE . 43.5 pt -87.74 -6.24 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 115.005 1.483 . . . . 2.61 115.005 -177.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 66.8 m -19.91 -58.38 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.543 2.053 . . . . 2.06 116.543 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -99.27 -7.63 26.13 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.983 -1.462 . . . . 2.07 111.022 -163.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 625' ' ' LEU . . . . . 0.653 HD12 ' HB3' ' B' ' 573' ' ' MET . 8.8 mp -71.84 146.93 47.64 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 123.289 0.368 . . . . 2.24 111.687 -173.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 626' ' ' GLN . . . . . 0.546 ' HB3' ' HD2' ' B' ' 627' ' ' PRO . 49.2 mt-30 -76.84 162.1 71.47 Favored Pre-proline 0 CA--C 1.518 -0.262 0 N-CA-C 108.818 -0.808 . . . . 2.99 108.818 174.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 627' ' ' PRO . . . . . 0.546 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 6.1 Cg_endo -47.84 -43.62 28.91 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.813 1.428 . . . . 0.86 115.813 -178.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 628' ' ' GLN . . . . . 0.51 ' NE2' ' H ' ' B' ' 628' ' ' GLN . 2.1 mp0 -67.28 -43.03 82.78 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.396 -0.522 . . . . 3.24 109.602 -174.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -63.25 -38.3 90.61 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.968 -0.56 . . . . 2.79 110.92 178.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 630' ' ' VAL . . . . . . . . . . . . . 93.5 t . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.22 -0.895 . . . . 1.93 110.644 176.742 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 504' ' ' ILE . . . . . 0.659 HD11 ' H1 ' ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.291 0 N-CA-C 113.112 0.782 . . . . 2.63 113.112 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 77.9 p -48.89 119.2 3.02 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.548 0.573 . . . . 1.82 112.548 174.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.78 1.51 67.89 Favored Glycine 0 CA--C 1.526 0.741 0 C-N-CA 120.948 -0.644 . . . . 0.0 114.468 -179.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.52 41.51 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.653 0.727 . . . . 1.02 112.456 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 508' ' ' MET . . . . . 0.431 ' HE3' HG12 ' B' ' 504' ' ' ILE . 3.8 mpp? -112.5 160.02 18.2 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 121.196 0.522 . . . . 2.72 112.214 174.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 509' ' ' HIS . . . . . 0.428 ' HD1' ' HB3' ' B' ' 511' ' ' GLU . 55.0 t-80 -69.78 134.19 48.29 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.056 -0.72 . . . . 3.51 109.056 174.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 510' ' ' GLU . . . . . 0.481 ' O ' ' HG3' ' B' ' 514' ' ' LYS . 38.7 mt-10 -41.62 -35.33 0.73 Allowed 'General case' 0 C--O 1.24 0.565 0 N-CA-C 113.498 0.925 . . . . 2.66 113.498 -173.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 511' ' ' GLU . . . . . 0.428 ' HB3' ' HD1' ' B' ' 509' ' ' HIS . 41.8 tt0 -73.87 -41.94 61.49 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.485 -0.78 . . . . 2.44 112.086 -176.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -64.93 -40.03 94.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.133 0.492 . . . . 2.08 110.862 171.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -53.77 -48.55 69.65 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.344 -0.843 . . . . 1.92 111.155 177.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 514' ' ' LYS . . . . . 0.481 ' HG3' ' O ' ' B' ' 510' ' ' GLU . 67.1 mttm -54.92 -57.62 10.92 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 116.476 -0.329 . . . . 3.15 111.852 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 515' ' ' ARG . . . . . 0.413 ' O ' HG22 ' B' ' 518' ' ' VAL . 5.8 tmm_? -56.59 -35.97 68.84 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.173 0.921 . . . . 4.26 111.086 -177.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -76.06 -45.59 33.42 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.118 -0.947 . . . . 2.37 110.535 -173.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 517' ' ' LEU . . . . . 0.499 ' HA ' HG11 ' B' ' 520' ' ' VAL . 4.5 mm? -66.75 -32.23 73.39 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.742 -0.663 . . . . 2.46 112.627 177.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 518' ' ' VAL . . . . . 0.445 HG12 ' O ' ' B' ' 514' ' ' LYS . 35.9 m -67.48 -35.17 72.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 118.535 -1.266 . . . . 2.02 109.034 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 42.2 m -72.89 -36.42 67.33 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.428 0.633 . . . . 1.82 112.42 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 520' ' ' VAL . . . . . 0.499 HG11 ' HA ' ' B' ' 517' ' ' LEU . 7.1 p -71.19 -42.32 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 O-C-N 122.115 -0.366 . . . . 1.86 111.663 -174.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 521' ' ' ILE . . . . . 0.469 HG22 ' O ' ' B' ' 517' ' ' LEU . 14.3 tt -90.71 -25.7 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.473 1.657 . . . . 2.46 115.473 -175.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 6.1 tmmm? -60.86 -35.24 76.09 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.666 -0.864 . . . . 2.99 108.666 173.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -92.41 -21.54 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.008 1.484 . . . . 2.17 115.008 -177.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 80.5 mt -70.52 -45.44 65.56 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.315 -0.624 . . . . 2.08 109.315 168.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 85.0 mt -52.23 -45.42 65.28 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-O 121.273 0.559 . . . . 2.48 110.971 169.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.56 -40.48 94.21 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 -178.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 66.3 mt -63.7 -36.08 82.67 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.021 0.439 . . . . 2.2 111.382 175.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 40.7 t -63.47 -47.74 80.55 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.104 -0.498 . . . . 1.05 110.706 -175.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.7 -29.64 70.23 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.446 -0.797 . . . . 2.5 112.578 173.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -71.58 -54.76 9.43 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 113.384 0.883 . . . . 2.83 113.384 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -68.75 137.87 54.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.937 -0.574 . . . . 2.73 111.047 -177.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 532' ' ' ARG . . . . . 0.566 ' HD3' ' HZ1' ' B' ' 537' ' ' LYS . 21.7 tpp180 -96.42 160.73 14.25 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.798 -0.637 . . . . 4.81 110.166 178.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.62 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.854 -0.612 . . . . 0.0 114.022 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -47.08 -36.66 8.46 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.196 0.813 . . . . 3.36 113.196 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -50.51 -51.86 43.75 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 120.367 -0.533 . . . . 2.2 110.857 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 536' ' ' ASN . . . . . 0.426 ' O ' HG23 ' B' ' 539' ' ' ILE . 0.2 OUTLIER -66.13 -44.78 83.23 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.603 0.594 . . . . 2.09 112.603 178.359 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 537' ' ' LYS . . . . . 0.566 ' HZ1' ' HD3' ' B' ' 532' ' ' ARG . 62.6 mttp -67.87 -31.94 72.09 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.93 110.272 -174.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.17 -46.96 69.29 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.886 -0.597 . . . . 1.02 111.092 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 539' ' ' ILE . . . . . 0.467 HG22 ' N ' ' B' ' 540' ' ' ILE . 8.2 tp -58.22 -54.91 26.09 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 2.34 111.247 173.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 540' ' ' ILE . . . . . 0.467 ' N ' HG22 ' B' ' 539' ' ' ILE . 48.4 mm -56.79 -48.06 81.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 2.37 110.607 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.51 -44.06 84.72 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 113.645 0.98 . . . . 0.69 113.645 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 542' ' ' SER . . . . . 0.473 ' HA ' ' HE3' ' B' ' 545' ' ' MET . 94.9 p -60.35 -38.88 85.22 Favored 'General case' 0 C--O 1.22 -0.478 0 C-N-CA 120.6 -0.44 . . . . 1.63 110.3 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -68.95 -47.17 66.33 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 114.323 1.231 . . . . 2.41 114.323 -175.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 544' ' ' ILE . . . . . 0.416 HG22 HG13 ' B' ' 521' ' ' ILE . 85.2 mt -52.55 -45.94 47.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.586 -0.894 . . . . 2.23 108.586 169.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 545' ' ' MET . . . . . 0.473 ' HE3' ' HA ' ' B' ' 542' ' ' SER . 74.2 mtm -64.03 -42.29 97.14 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.763 -0.775 . . . . 3.06 112.818 179.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -58.34 -48.8 79.42 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 119.234 -0.986 . . . . 2.36 109.838 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 95.0 mt -55.07 -61.41 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 112.846 0.684 . . . . 2.07 112.846 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 548' ' ' VAL . . . . . 0.567 HG22 HD23 ' B' ' 555' ' ' LEU . 10.5 p -47.36 -44.21 8.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.838 -0.745 . . . . 2.03 111.442 176.213 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 549' ' ' GLY . . . . . 0.515 ' HA2' HD13 ' B' ' 591' ' ' ILE . . . -57.41 -28.08 58.9 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -87.01 -9.53 55.33 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 112.629 0.604 . . . . 2.85 112.629 -175.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -120.46 59.66 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.796 1.035 . . . . 3.84 113.796 -176.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 552' ' ' PRO . . . . . 0.531 ' HG3' ' HG2' ' B' ' 594' ' ' LYS . 13.3 Cg_endo -55.93 -39.43 91.19 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 O-C-N 122.087 0.52 . . . . 0.89 113.114 177.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -56.26 -46.77 79.52 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 121.145 0.498 . . . . 4.49 109.926 -174.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -48.98 -59.71 3.38 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 123.953 0.901 . . . . 1.05 112.046 168.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 555' ' ' LEU . . . . . 0.58 HD11 ' HA ' ' B' ' 562' ' ' LEU . 4.3 mm? -54.3 -48.66 71.04 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 116.334 -0.394 . . . . 2.09 110.158 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . 0.528 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 21.3 ttm180 -53.87 -35.8 61.94 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.857 1.058 . . . . 3.63 113.857 -178.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.1 -12.22 50.64 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.48 -0.488 . . . . 1.0 112.043 -177.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 33.8 m80 -128.19 78.47 1.84 Allowed 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.404 1.261 . . . . 3.8 114.404 -177.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 47.1 p90 -50.47 -48.28 56.71 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 116.59 2.07 . . . . 3.87 116.59 -176.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -56.7 -36.61 69.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 3.79 111.099 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 561' ' ' PHE . . . . . 0.424 ' O ' HG22 ' B' ' 565' ' ' VAL . 1.7 t80 -74.91 -45.15 44.61 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 119.163 -1.015 . . . . 1.8 111.847 175.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . 0.58 ' HA ' HD11 ' B' ' 555' ' ' LEU . 5.5 tt -49.96 -59.18 4.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.498 0.319 . . . . 1.94 110.229 175.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 563' ' ' LYS . . . . . 0.443 ' HA ' HG23 ' B' ' 566' ' ' VAL . 39.7 tttm -50.2 -38.63 40.92 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.831 1.049 . . . . 3.16 113.831 178.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 23.3 p -71.81 -39.36 69.89 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.5 0.667 . . . . 1.88 110.366 -176.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 565' ' ' VAL . . . . . 0.424 HG22 ' O ' ' B' ' 561' ' ' PHE . 99.6 t -62.88 -41.28 92.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.628 -0.714 . . . . 1.81 112.49 173.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 566' ' ' VAL . . . . . 0.675 ' HA ' HD23 ' B' ' 569' ' ' LEU . 30.3 m -71.01 -50.9 39.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 C-N-CA 120.485 -0.486 . . . . 2.0 110.793 -176.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 567' ' ' ASN . . . . . 0.45 ' N ' HG22 ' B' ' 566' ' ' VAL . 15.3 m120 -51.07 -37.38 45.23 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 116.002 -0.545 . . . . 2.53 112.007 170.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 568' ' ' LYS . . . . . 0.401 ' HE2' ' HB3' ' B' ' 568' ' ' LYS . 29.8 ttpt -72.64 -32.67 66.06 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.77 -0.456 . . . . 3.93 109.77 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 569' ' ' LEU . . . . . 0.675 HD23 ' HA ' ' B' ' 566' ' ' VAL . 0.2 OUTLIER -67.5 -36.49 81.17 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.687 -0.857 . . . . 2.53 108.687 177.058 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 570' ' ' PHE . . . . . 0.523 ' HD1' HG13 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.38 -39.27 92.05 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.907 -0.405 . . . . 4.72 109.907 178.346 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -57.74 -53.49 57.61 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.982 -0.687 . . . . 2.47 110.47 176.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 572' ' ' PHE . . . . . 0.62 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 22.6 m-85 -62.45 -9.98 10.17 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.118 1.155 . . . . 1.87 114.118 -177.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 573' ' ' MET . . . . . 0.495 ' HB3' HD23 ' B' ' 625' ' ' LEU . 35.5 mtt -76.38 -5.26 46.44 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.641 0.734 . . . . 2.56 109.651 178.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -109.44 -0.56 18.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.82 -1.082 . . . . 4.11 111.411 173.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 575' ' ' GLU . . . . . 0.62 ' HG2' ' HA ' ' B' ' 572' ' ' PHE . 29.4 mm-40 -68.53 130.23 42.25 Favored 'General case' 0 C--O 1.233 0.221 0 O-C-N 123.422 0.451 . . . . 1.57 110.077 177.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 82.7 p -87.84 -21.36 25.07 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 113.011 0.745 . . . . 2.01 113.011 -177.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -60.09 128.03 34.81 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.425 0.631 . . . . 3.71 112.532 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -44.96 125.84 5.42 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.332 -0.849 . . . . 2.15 113.119 -171.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.27 -34.69 4.8 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.219 1.247 . . . . 0.0 116.219 174.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 55.5 t -53.72 -46.42 62.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.13 0.789 . . . . 1.89 113.13 -175.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.53 ' HB3' HE22 ' B' ' 629' ' ' GLN . 66.3 mt-30 -59.57 -42.34 92.26 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.406 0.521 . . . . 2.46 112.406 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -60.53 -42.41 96.42 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 112.19 0.441 . . . . 2.23 112.19 172.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 6.9 tpt -60.7 -49.53 77.15 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 121.058 -0.257 . . . . 3.01 110.416 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.79 -42.93 80.32 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.181 -0.463 . . . . 1.01 111.692 -177.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 585' ' ' CYS . . . . . 0.42 ' O ' HG13 ' B' ' 589' ' ' ILE . 52.0 t -74.49 -40.87 61.55 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 119.976 -0.69 . . . . 2.2 111.91 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.54 -46.34 89.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.351 -0.386 . . . . 1.98 111.995 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 86.4 m -62.21 -41.22 98.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.92 110.381 175.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 588' ' ' PHE . . . . . 0.44 ' HB2' ' CD1' ' B' ' 569' ' ' LEU . 19.2 t80 -61.44 -32.23 72.2 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.089 -0.505 . . . . 0.72 111.146 -177.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 589' ' ' ILE . . . . . 0.42 HG13 ' O ' ' B' ' 585' ' ' CYS . 68.8 mt -79.86 -35.99 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.008 0 C-N-CA 116.902 -1.919 . . . . 2.46 109.773 -175.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -57.47 -50.04 74.32 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 107.717 -1.216 . . . . 3.09 107.717 176.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . 0.515 HD13 ' HA2' ' B' ' 549' ' ' GLY . 1.7 mp -63.77 -43.74 98.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.693 -0.685 . . . . 2.43 112.815 -177.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.95 -39.12 93.41 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.443 -0.503 . . . . 1.01 112.275 177.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -62.37 -70.02 0.22 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 119.096 -1.041 . . . . 2.88 109.834 174.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 594' ' ' LYS . . . . . 0.531 ' HG2' ' HG3' ' B' ' 552' ' ' PRO . 0.0 OUTLIER -56.14 -23.8 36.91 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 116.655 2.095 . . . . 2.67 116.655 -176.565 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 83.8 m -121.63 25.21 9.42 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.243 1.201 . . . . 1.97 114.243 -178.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -48.59 -38.49 20.9 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.792 1.775 . . . . 4.07 115.792 -172.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . 0.425 ' O ' ' HG2' ' B' ' 601' ' ' GLN . 38.5 mmt180 -69.52 -32.69 71.69 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.202 0.816 . . . . 4.32 113.202 -175.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 598' ' ' HIS . . . . . 0.528 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 31.3 m80 -70.13 -3.82 18.49 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.662 -0.699 . . . . 2.88 112.053 -173.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 599' ' ' PHE . . . . . 0.47 ' HB3' HG22 ' B' ' 611' ' ' ILE . 74.8 m-85 -105.52 -16.94 14.57 Favored 'General case' 0 CA--C 1.517 -0.295 0 O-C-N 123.669 0.606 . . . . 3.7 110.279 -176.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 10.0 p -105.81 -24.36 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.031 -0.986 . . . . 2.05 111.311 -175.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 601' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 30.3 pt20 -102.02 139.5 37.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.578 -0.849 . . . . 2.81 111.569 176.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 6.6 m -60.91 122.71 12.1 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.441 0 N-CA-C 108.599 -0.889 . . . . 1.99 108.599 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 603' ' ' GLN . . . . . 0.429 ' HB2' ' HE1' ' B' ' 610' ' ' PHE . 82.7 mm-40 -92.78 167.31 11.95 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 123.729 0.643 . . . . 3.39 110.048 -177.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 62.1 t -71.98 128.99 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 113.018 0.748 . . . . 1.91 113.018 -175.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.4 6.5 64.38 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.039 -175.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -131.5 158.08 41.83 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.651 -0.82 . . . . 2.51 110.788 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 607' ' ' VAL . . . . . 0.572 HG22 ' HG2' ' B' ' 608' ' ' MET . 19.0 m -103.29 -22.59 4.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.023 -0.989 . . . . 2.03 112.447 -175.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 608' ' ' MET . . . . . 0.572 ' HG2' HG22 ' B' ' 607' ' ' VAL . 94.1 mmm -136.99 142.22 37.62 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 112.649 0.611 . . . . 3.15 112.649 -174.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -52.07 130.84 36.65 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 120.899 1.066 . . . . 0.85 112.165 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 610' ' ' PHE . . . . . 0.429 ' HE1' ' HB2' ' B' ' 603' ' ' GLN . 7.8 m-85 -56.96 -31.8 65.39 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 111.874 0.324 . . . . 3.05 111.874 -174.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 611' ' ' ILE . . . . . 0.47 HG22 ' HB3' ' B' ' 599' ' ' PHE . 10.3 pt -50.07 -44.79 22.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-O 120.726 0.298 . . . . 2.38 110.548 178.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -50.01 -52.02 37.3 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.597 0.759 . . . . 2.15 112.821 177.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -59.96 -37.05 78.47 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.535 -0.466 . . . . 2.66 110.234 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 60.5 mt -64.44 -48.1 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 120.246 -0.582 . . . . 2.28 111.925 178.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 55.0 tp -62.61 -31.17 71.96 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.955 0.724 . . . . 2.38 112.955 -177.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -79.5 2.12 23.23 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.621 1.341 . . . . 2.62 114.621 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 617' ' ' ASN . . . . . 0.434 ' O ' HG22 ' B' ' 621' ' ' ILE . 38.8 m-80 -142.44 15.67 2.01 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.168 0.803 . . . . 2.63 113.168 -174.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 618' ' ' ILE . . . . . 0.446 HG13 ' N ' ' B' ' 619' ' ' ASN . 20.9 pt -46.92 -47.06 8.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 C-N-CA 118.957 -1.097 . . . . 2.47 110.127 -176.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 619' ' ' ASN . . . . . 0.446 ' N ' HG13 ' B' ' 618' ' ' ILE . 18.8 m120 -63.2 -51.05 67.89 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.787 1.032 . . . . 2.98 113.787 -176.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 42.0 m -56.92 -31.83 65.33 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 119.455 -0.898 . . . . 1.94 110.763 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 621' ' ' ILE . . . . . 0.523 HG13 ' HD1' ' B' ' 570' ' ' PHE . 15.0 tt -79.35 -42.61 23.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 115.355 1.613 . . . . 2.57 115.355 -179.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 622' ' ' ILE . . . . . 0.424 HG23 HG21 ' B' ' 621' ' ' ILE . 38.3 pt -87.73 -6.24 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 115.09 1.515 . . . . 2.61 115.09 -177.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.7 t -19.9 -58.39 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 116.598 2.073 . . . . 2.06 116.598 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -99.21 -7.56 26.33 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 113.981 -1.463 . . . . 2.07 111.056 -164.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 625' ' ' LEU . . . . . 0.565 HD22 HE21 ' B' ' 629' ' ' GLN . 90.2 mt -71.9 146.91 47.54 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.264 0.352 . . . . 2.24 111.654 -173.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 626' ' ' GLN . . . . . 0.421 ' O ' HG22 ' B' ' 630' ' ' VAL . 30.0 mm-40 -76.84 162.09 71.51 Favored Pre-proline 0 CA--C 1.519 -0.233 0 N-CA-C 108.773 -0.825 . . . . 2.99 108.773 174.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -47.83 -43.61 28.88 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.813 1.428 . . . . 0.86 115.813 -178.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.25 -43.01 82.97 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 120.423 -0.511 . . . . 3.24 109.686 -174.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 629' ' ' GLN . . . . . 0.565 HE21 HD22 ' B' ' 625' ' ' LEU . 25.2 mt-30 -63.35 -38.16 90.07 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.856 -0.611 . . . . 2.79 110.904 178.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 630' ' ' VAL . . . . . 0.421 HG22 ' O ' ' B' ' 626' ' ' GLN . 67.2 t . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.33 -0.843 . . . . 1.93 110.687 176.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 35.0 pt . . . . . 0 C--O 1.235 0.291 0 N-CA-C 113.06 0.763 . . . . 2.63 113.06 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 42.3 t -49.01 119.21 3.06 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.545 0.572 . . . . 1.82 112.545 174.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.79 1.5 67.87 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.995 -0.621 . . . . 0.0 114.418 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.31 -7.53 41.59 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.711 0.755 . . . . 1.02 112.443 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 24.6 mmt -112.46 159.96 18.23 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 121.123 0.487 . . . . 2.72 112.297 174.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -69.78 134.19 48.29 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.119 -0.697 . . . . 3.51 109.119 174.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -41.67 -35.4 0.76 Allowed 'General case' 0 C--O 1.24 0.567 0 N-CA-C 113.401 0.889 . . . . 2.66 113.401 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -73.74 -41.91 61.87 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.505 -0.771 . . . . 2.44 112.17 -176.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -64.9 -40.18 94.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.16 0.505 . . . . 2.08 110.831 171.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -53.61 -48.76 68.98 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.357 -0.838 . . . . 1.92 111.084 177.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -54.76 -57.66 10.66 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 111.917 0.34 . . . . 3.15 111.917 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 515' ' ' ARG . . . . . 0.414 ' O ' HG13 ' B' ' 518' ' ' VAL . 39.5 ttm180 -56.6 -35.93 68.83 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.132 0.895 . . . . 4.26 111.086 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.434 ' O ' HG21 ' B' ' 520' ' ' VAL . 56.7 t80 -76.14 -45.6 32.8 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.104 -0.953 . . . . 2.37 110.504 -173.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 517' ' ' LEU . . . . . 0.49 ' O ' HG12 ' B' ' 521' ' ' ILE . 93.6 mt -66.72 -32.1 73.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.685 -0.689 . . . . 2.46 112.752 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 518' ' ' VAL . . . . . 0.414 HG13 ' O ' ' B' ' 515' ' ' ARG . 12.6 p -67.6 -35.03 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 118.456 -1.297 . . . . 2.02 109.075 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 40.6 p -73.01 -36.3 66.98 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.82 112.391 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 520' ' ' VAL . . . . . 0.434 HG21 ' O ' ' B' ' 516' ' ' PHE . 51.1 t -71.29 -42.22 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.416 -0.356 . . . . 1.86 111.716 -174.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 521' ' ' ILE . . . . . 0.49 HG12 ' O ' ' B' ' 517' ' ' LEU . 18.6 pt -90.78 -25.68 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 115.391 1.626 . . . . 2.46 115.391 -175.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 26.6 ttpp -60.91 -35.12 75.86 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.681 -0.859 . . . . 2.99 108.681 173.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -92.43 -21.52 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.991 1.478 . . . . 2.17 114.991 -177.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 524' ' ' LEU . . . . . 0.502 ' HG ' HD13 ' B' ' 540' ' ' ILE . 4.6 mp -70.63 -45.43 65.21 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.28 -0.637 . . . . 2.08 109.28 169.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 26.9 tp -52.15 -45.56 65.07 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.253 0.549 . . . . 2.48 110.953 169.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.43 -40.52 94.47 Favored Glycine 0 N--CA 1.445 -0.735 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 527' ' ' LEU . . . . . 0.526 HD13 HE21 ' B' ' 530' ' ' GLN . 39.6 tp -63.55 -36.12 82.73 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.035 0.445 . . . . 2.2 111.402 175.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 41.8 t -63.49 -47.81 80.22 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 116.065 -0.516 . . . . 1.05 110.632 -175.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -61.73 -29.5 70.16 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.467 -0.788 . . . . 2.5 112.615 173.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 530' ' ' GLN . . . . . 0.526 HE21 HD13 ' B' ' 527' ' ' LEU . 10.3 tt0 -71.7 -54.76 9.27 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.336 0.865 . . . . 2.83 113.336 -177.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.73 137.95 54.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.014 -0.539 . . . . 2.73 111.099 -177.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 11.1 ptp180 -96.5 160.71 14.25 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.83 -0.623 . . . . 4.81 110.117 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.62 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.854 -0.612 . . . . 0.0 114.022 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -47.14 -36.58 8.64 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.207 0.817 . . . . 3.36 113.207 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -50.59 -51.77 45.29 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 120.373 -0.531 . . . . 2.2 110.846 174.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -66.14 -44.84 83.01 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.59 0.589 . . . . 2.09 112.59 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 537' ' ' LYS . . . . . 0.542 ' HA ' HG23 ' B' ' 540' ' ' ILE . 60.3 mttm -67.84 -32.0 72.22 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.93 110.263 -174.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.12 -46.91 69.58 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 115.832 -0.622 . . . . 1.02 111.137 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 78.8 mt -58.25 -54.91 26.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 2.34 111.247 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 540' ' ' ILE . . . . . 0.542 HG23 ' HA ' ' B' ' 537' ' ' LYS . 10.6 tp -56.73 -48.16 81.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 2.37 110.601 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 541' ' ' ALA . . . . . 0.424 ' N ' HG22 ' B' ' 540' ' ' ILE . . . -57.47 -44.04 84.52 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.573 0.953 . . . . 0.69 113.573 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 542' ' ' SER . . . . . 0.548 ' O ' ' HG2' ' B' ' 545' ' ' MET . 94.7 p -60.47 -38.74 85.21 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.574 -0.45 . . . . 1.63 110.296 -178.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -69.03 -47.14 66.16 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.316 1.228 . . . . 2.41 114.316 -175.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 544' ' ' ILE . . . . . 0.411 HG21 ' N ' ' B' ' 545' ' ' MET . 14.7 tt -52.64 -46.0 48.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.46 -0.941 . . . . 2.23 108.46 170.061 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 545' ' ' MET . . . . . 0.548 ' HG2' ' O ' ' B' ' 542' ' ' SER . 0.0 OUTLIER -64.04 -42.31 97.1 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.688 -0.805 . . . . 3.06 112.757 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -58.34 -48.76 79.52 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 119.213 -0.995 . . . . 2.36 109.867 176.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 547' ' ' ILE . . . . . 0.405 HG21 ' N ' ' B' ' 548' ' ' VAL . 1.7 mp -55.09 -61.38 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.854 0.687 . . . . 2.07 112.854 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 548' ' ' VAL . . . . . 0.571 HG22 HD11 ' B' ' 555' ' ' LEU . 9.9 p -47.29 -44.32 8.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.843 -0.743 . . . . 2.03 111.43 176.193 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 549' ' ' GLY . . . . . 0.405 ' N ' HG12 ' B' ' 548' ' ' VAL . . . -57.4 -28.02 58.81 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.764 -0.585 . . . . 0.0 112.934 -177.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 550' ' ' GLN . . . . . 0.439 ' C ' ' HD3' ' B' ' 552' ' ' PRO . 32.5 tt0 -87.06 -9.52 55.24 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.617 0.599 . . . . 2.85 112.617 -175.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -120.44 59.64 7.08 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 113.823 1.046 . . . . 3.84 113.823 -176.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 552' ' ' PRO . . . . . 0.552 ' HG2' ' HG2' ' B' ' 594' ' ' LYS . 44.2 Cg_exo -55.96 -39.4 91.41 Favored 'Trans proline' 0 C--O 1.222 -0.291 0 O-C-N 122.124 0.539 . . . . 0.89 113.151 177.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 553' ' ' ARG . . . . . 0.444 ' HA ' ' HE ' ' B' ' 556' ' ' ARG . 98.9 mtt180 -56.27 -46.68 79.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.164 0.507 . . . . 4.49 109.99 -174.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.04 -59.7 3.4 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 123.931 0.892 . . . . 1.05 112.108 167.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 555' ' ' LEU . . . . . 0.571 HD11 HG22 ' B' ' 548' ' ' VAL . 87.0 mt -54.4 -48.51 71.48 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 116.322 -0.399 . . . . 2.09 110.177 -178.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . 0.444 ' HE ' ' HA ' ' B' ' 553' ' ' ARG . 59.5 mtm180 -53.93 -35.87 62.16 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.827 1.047 . . . . 3.63 113.827 -178.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.03 -12.26 50.73 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.528 -0.469 . . . . 1.0 112.078 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 558' ' ' HIS . . . . . 0.553 ' ND1' ' HB2' ' B' ' 561' ' ' PHE . 8.5 t-160 -128.22 78.48 1.84 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.405 1.261 . . . . 3.8 114.405 -177.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 34.6 p90 -50.48 -48.29 56.8 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 116.526 2.047 . . . . 3.87 116.526 -176.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -56.71 -36.55 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.303 -0.408 . . . . 3.79 111.15 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 561' ' ' PHE . . . . . 0.553 ' HB2' ' ND1' ' B' ' 558' ' ' HIS . 9.0 t80 -74.96 -45.06 44.86 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 119.1 -1.04 . . . . 1.8 111.908 175.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . 0.559 HD12 ' HB3' ' B' ' 555' ' ' LEU . 62.3 tp -49.97 -59.22 4.09 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.515 0.326 . . . . 1.94 110.255 175.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 563' ' ' LYS . . . . . 0.427 ' O ' HG11 ' B' ' 566' ' ' VAL . 39.7 ttmt -50.16 -38.66 40.54 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.893 1.071 . . . . 3.16 113.893 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 23.5 p -71.71 -39.42 70.17 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.572 0.701 . . . . 1.88 110.412 -176.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 565' ' ' VAL . . . . . 0.4 HG23 ' O ' ' B' ' 561' ' ' PHE . 85.1 t -62.84 -41.34 92.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.646 -0.706 . . . . 1.81 112.527 173.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 566' ' ' VAL . . . . . 0.501 HG13 ' N ' ' B' ' 567' ' ' ASN . 13.1 p -70.96 -50.85 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.537 -0.465 . . . . 2.0 110.875 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 567' ' ' ASN . . . . . 0.501 ' N ' HG13 ' B' ' 566' ' ' VAL . 2.8 t-20 -51.04 -37.47 45.55 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.009 -0.541 . . . . 2.53 112.044 170.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -72.69 -32.63 65.93 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.716 -0.475 . . . . 3.93 109.716 -179.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 569' ' ' LEU . . . . . 0.479 ' O ' ' HG3' ' B' ' 573' ' ' MET . 60.1 mt -67.5 -36.41 81.02 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 108.696 -0.853 . . . . 2.53 108.696 177.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -65.35 -39.38 92.28 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.868 -0.419 . . . . 4.72 109.868 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -57.7 -53.51 57.38 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 119.985 -0.686 . . . . 2.47 110.495 176.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 572' ' ' PHE . . . . . 0.605 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 18.6 m-85 -62.44 -9.86 9.79 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.093 1.146 . . . . 1.87 114.093 -177.189 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 573' ' ' MET . . . . . 0.699 ' HB3' HD13 ' B' ' 625' ' ' LEU . 67.9 mtt -76.47 -5.26 46.7 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.637 0.732 . . . . 2.56 109.662 178.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -109.49 -0.57 18.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.765 -1.107 . . . . 4.11 111.492 173.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 575' ' ' GLU . . . . . 0.605 ' HG2' ' HA ' ' B' ' 572' ' ' PHE . 25.2 mm-40 -68.47 130.15 42.01 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.169 -0.469 . . . . 1.57 110.214 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 76.8 p -87.79 -21.41 25.12 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.941 0.719 . . . . 2.01 112.941 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -60.1 128.05 34.9 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.418 0.627 . . . . 3.71 112.584 -175.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -44.95 125.88 5.44 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.372 -0.831 . . . . 2.15 113.103 -171.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 579' ' ' GLY . . . . . 0.401 ' O ' ' HG2' ' B' ' 583' ' ' MET . . . 96.23 -34.74 4.76 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.195 1.238 . . . . 0.0 116.195 174.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 47.1 t -53.77 -46.22 62.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.173 0.805 . . . . 1.89 113.173 -175.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -59.75 -42.27 92.87 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.333 0.494 . . . . 2.46 112.333 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -60.53 -42.46 96.55 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 112.202 0.445 . . . . 2.23 112.202 172.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 583' ' ' MET . . . . . 0.536 ' HB3' ' SD ' ' B' ' 545' ' ' MET . 28.6 mmt -60.66 -49.47 77.37 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.99 -0.284 . . . . 3.01 110.475 175.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.97 80.32 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.197 -0.456 . . . . 1.01 111.722 -177.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 77.5 m -74.32 -41.02 61.82 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 120.078 -0.649 . . . . 2.2 111.949 -177.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 586' ' ' ASP . . . . . 0.474 ' O ' HG21 ' B' ' 589' ' ' ILE . 69.2 m-20 -59.56 -46.3 89.3 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 116.252 -0.431 . . . . 1.98 111.984 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 587' ' ' THR . . . . . 0.472 ' HG1' ' HG3' ' B' ' 545' ' ' MET . 73.7 m -62.19 -41.22 98.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.92 110.43 175.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -61.45 -32.23 72.2 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.085 -0.507 . . . . 0.72 111.177 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 589' ' ' ILE . . . . . 0.474 HG21 ' O ' ' B' ' 586' ' ' ASP . 10.0 tp -79.88 -35.95 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.835 -1.946 . . . . 2.46 109.74 -175.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . 0.433 ' N ' HG23 ' B' ' 589' ' ' ILE . 67.1 mttm -57.51 -50.02 74.44 Favored 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 107.697 -1.223 . . . . 3.09 107.697 176.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 74.6 mt -63.76 -43.85 98.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 123.345 0.658 . . . . 2.43 112.77 -177.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.08 93.37 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.417 -0.513 . . . . 1.01 112.331 177.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -62.35 -70.14 0.22 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 119.12 -1.032 . . . . 2.88 109.783 174.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 594' ' ' LYS . . . . . 0.552 ' HG2' ' HG2' ' B' ' 552' ' ' PRO . 0.0 OUTLIER -56.02 -23.79 35.27 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 116.69 2.107 . . . . 2.67 116.69 -176.564 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 74.3 m -121.74 25.26 9.34 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.249 1.203 . . . . 1.97 114.249 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 596' ' ' ARG . . . . . 0.479 ' HG3' ' HD3' ' B' ' 597' ' ' ARG . 24.3 ptt180 -48.48 -38.54 20.32 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.856 1.799 . . . . 4.07 115.856 -172.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . 0.479 ' HD3' ' HG3' ' B' ' 596' ' ' ARG . 0.5 OUTLIER -69.66 -32.53 71.24 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.225 0.824 . . . . 4.32 113.225 -175.512 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 51.8 m-70 -70.09 -3.86 18.54 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-N 115.581 -0.736 . . . . 2.88 112.054 -173.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -105.55 -16.93 14.57 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.613 0.571 . . . . 3.7 110.18 -176.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 33.8 m -105.82 -24.41 4.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 CA-C-N 115.114 -0.948 . . . . 2.05 111.242 -175.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 601' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 3.5 pt20 -101.95 139.49 37.51 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.56 -0.856 . . . . 2.81 111.635 176.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 48.9 t -60.89 122.66 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 108.596 -0.89 . . . . 1.99 108.596 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -92.67 167.3 11.99 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.649 0.593 . . . . 3.39 110.138 -177.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 40.5 t -71.99 129.03 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 119.87 -0.732 . . . . 1.91 112.968 -175.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.31 6.6 64.45 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.096 -175.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 606' ' ' GLU . . . . . 0.466 ' HG3' ' H ' ' B' ' 608' ' ' MET . 10.5 tp10 -131.46 157.98 42.05 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.667 -0.813 . . . . 2.51 110.841 175.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 33.9 m -103.24 -22.53 4.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.063 -0.972 . . . . 2.03 112.507 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 608' ' ' MET . . . . . 0.466 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 52.6 ttm -136.97 142.18 37.5 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.651 0.611 . . . . 3.15 112.651 -174.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 609' ' ' PRO . . . . . 0.459 ' HD2' ' HG3' ' B' ' 608' ' ' MET . 54.2 Cg_exo -52.11 130.96 37.28 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.89 1.06 . . . . 0.85 112.086 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -57.03 -31.86 65.58 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 123.183 0.302 . . . . 3.05 111.799 -174.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 611' ' ' ILE . . . . . . . . . . . . . 13.4 tt -49.92 -44.97 21.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 120.816 0.341 . . . . 2.38 110.538 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -49.86 -52.0 36.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.612 0.765 . . . . 2.15 112.875 177.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.02 -37.06 78.64 Favored 'General case' 0 C--O 1.244 0.802 0 C-N-CA 120.555 -0.458 . . . . 2.66 110.183 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 72.6 mt -64.53 -47.93 87.1 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 120.214 -0.594 . . . . 2.28 112.002 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 93.3 mt -62.67 -31.17 72.0 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.955 0.724 . . . . 2.38 112.955 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -79.5 2.12 23.23 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.621 1.341 . . . . 2.62 114.621 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 617' ' ' ASN . . . . . 0.591 ' HB2' HG21 ' B' ' 620' ' ' THR . 26.2 p30 -142.44 15.62 2.01 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.168 0.803 . . . . 2.63 113.168 -174.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 618' ' ' ILE . . . . . 0.479 HG13 ' N ' ' B' ' 619' ' ' ASN . 16.7 pt -46.9 -47.02 8.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.47 110.222 -176.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 619' ' ' ASN . . . . . 0.479 ' N ' HG13 ' B' ' 618' ' ' ILE . 7.3 t30 -63.12 -51.21 67.44 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 113.777 1.028 . . . . 2.98 113.777 -176.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 620' ' ' THR . . . . . 0.591 HG21 ' HB2' ' B' ' 617' ' ' ASN . 4.1 t -56.82 -31.87 65.16 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 119.445 -0.902 . . . . 1.94 110.785 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 621' ' ' ILE . . . . . 0.503 HG13 HG23 ' B' ' 622' ' ' ILE . 36.1 pt -79.26 -42.73 23.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 115.342 1.608 . . . . 2.57 115.342 -179.036 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 622' ' ' ILE . . . . . 0.503 HG23 HG13 ' B' ' 621' ' ' ILE . 39.5 pt -87.67 -6.32 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 115.031 1.493 . . . . 2.61 115.031 -177.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.3 t -19.9 -58.33 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 116.642 2.09 . . . . 2.06 116.642 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -99.35 -7.53 26.11 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.028 -1.442 . . . . 2.07 110.973 -163.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 625' ' ' LEU . . . . . 0.699 HD13 ' HB3' ' B' ' 573' ' ' MET . 9.5 mp -71.81 146.85 47.75 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.493 -0.321 . . . . 2.24 111.748 -173.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 626' ' ' GLN . . . . . 0.415 ' O ' HG22 ' B' ' 630' ' ' VAL . 24.8 mt-30 -76.73 162.09 71.69 Favored Pre-proline 0 N--CA 1.464 0.237 0 N-CA-C 108.843 -0.799 . . . . 2.99 108.843 174.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -47.81 -43.6 28.82 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.823 1.432 . . . . 0.86 115.823 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 628' ' ' GLN . . . . . 0.562 ' HA ' HE21 ' B' ' 628' ' ' GLN . 0.0 OUTLIER -67.33 -43.0 82.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.427 -0.509 . . . . 3.24 109.631 -174.621 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -63.31 -38.2 90.22 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.924 -0.58 . . . . 2.79 110.924 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 630' ' ' VAL . . . . . 0.415 HG22 ' O ' ' B' ' 626' ' ' GLN . 90.7 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.195 -0.907 . . . . 1.93 110.615 176.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 504' ' ' ILE . . . . . 0.687 HD13 ' H2 ' ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.339 0 N-CA-C 113.069 0.766 . . . . 2.63 113.069 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 79.2 p -48.83 119.13 2.95 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.542 0.571 . . . . 1.82 112.542 174.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.82 1.43 67.85 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 120.926 -0.654 . . . . 0.0 114.477 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.53 41.5 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.627 0.714 . . . . 1.02 112.443 176.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 63.2 mtt -112.47 159.99 18.22 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.11 0.481 . . . . 2.72 112.221 174.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -69.79 134.25 48.34 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.061 -0.718 . . . . 3.51 109.061 174.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -41.62 -35.48 0.76 Allowed 'General case' 0 C--O 1.241 0.623 0 N-CA-C 113.39 0.885 . . . . 2.66 113.39 -173.283 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -73.8 -41.92 61.69 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.541 -0.754 . . . . 2.44 112.087 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -64.88 -40.1 94.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.111 0.482 . . . . 2.08 110.863 171.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -53.64 -48.71 69.12 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.38 -0.827 . . . . 1.92 111.141 177.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 514' ' ' LYS . . . . . 0.52 ' O ' HG12 ' B' ' 518' ' ' VAL . 39.0 ttmt -54.88 -57.56 11.11 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 111.93 0.345 . . . . 3.15 111.93 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 515' ' ' ARG . . . . . 0.413 ' O ' HG21 ' B' ' 518' ' ' VAL . 28.2 mmm180 -56.62 -35.94 68.89 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 124.221 0.951 . . . . 4.26 111.124 -177.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.465 ' O ' HG11 ' B' ' 520' ' ' VAL . 70.8 t80 -76.08 -45.58 33.34 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.101 -0.954 . . . . 2.37 110.515 -173.37 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 517' ' ' LEU . . . . . 0.572 ' HA ' HG22 ' B' ' 520' ' ' VAL . 3.1 tt -66.76 -32.24 73.41 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.755 -0.657 . . . . 2.46 112.606 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 518' ' ' VAL . . . . . 0.52 HG12 ' O ' ' B' ' 514' ' ' LYS . 34.2 m -67.53 -35.07 72.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 118.473 -1.291 . . . . 2.02 109.087 178.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 47.8 m -72.96 -36.35 67.13 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.295 0.569 . . . . 1.82 112.437 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 520' ' ' VAL . . . . . 0.572 HG22 ' HA ' ' B' ' 517' ' ' LEU . 22.0 m -71.23 -42.35 74.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.418 -0.355 . . . . 1.86 111.643 -174.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 521' ' ' ILE . . . . . 0.501 HG12 ' O ' ' B' ' 517' ' ' LEU . 30.5 pt -90.64 -25.75 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 115.487 1.662 . . . . 2.46 115.487 -175.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.88 -35.24 76.12 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.694 -0.854 . . . . 2.99 108.694 173.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -92.36 -21.49 20.21 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.037 1.495 . . . . 2.17 115.037 -177.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 5.2 mp -70.61 -45.33 65.46 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.305 -0.628 . . . . 2.08 109.305 168.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 44.5 tp -52.31 -45.46 65.57 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 121.236 0.541 . . . . 2.48 110.91 169.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 526' ' ' GLY . . . . . 0.43 ' O ' ' HG2' ' B' ' 529' ' ' GLU . . . -66.5 -40.56 94.33 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -178.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 74.6 mt -63.57 -36.12 82.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 2.2 111.47 175.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 42.4 t -63.5 -47.77 80.36 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.041 -0.527 . . . . 1.05 110.634 -175.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 529' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' B' ' 526' ' ' GLY . 10.9 pt-20 -61.58 -29.71 70.2 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.544 -0.753 . . . . 2.5 112.542 173.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -71.62 -54.74 9.43 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.375 0.88 . . . . 2.83 113.375 -177.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -68.76 137.95 54.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.0 -0.545 . . . . 2.73 111.07 -177.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -96.46 160.6 14.32 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.813 -0.631 . . . . 4.81 110.16 178.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.53 119.56 1.37 Allowed Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 115.848 -0.614 . . . . 0.0 114.007 179.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -47.08 -36.63 8.42 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.241 0.83 . . . . 3.36 113.241 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -50.52 -51.92 43.3 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 120.33 -0.548 . . . . 2.2 110.851 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 536' ' ' ASN . . . . . 0.491 ' O ' HG23 ' B' ' 539' ' ' ILE . 18.7 m120 -65.95 -44.87 83.74 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.717 0.636 . . . . 2.09 112.717 178.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 537' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -67.76 -32.04 72.36 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.408 -0.517 . . . . 2.93 110.283 -174.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.13 -46.92 69.5 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.896 -0.593 . . . . 1.02 111.112 178.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 539' ' ' ILE . . . . . 0.494 ' CG2' ' N ' ' B' ' 540' ' ' ILE . 0.4 OUTLIER -58.19 -54.92 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.56 0.695 . . . . 2.34 111.307 173.42 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 540' ' ' ILE . . . . . 0.494 ' N ' ' CG2' ' B' ' 539' ' ' ILE . 82.4 mt -56.77 -48.18 81.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 2.37 110.566 -178.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.38 -44.05 84.1 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 113.68 0.993 . . . . 0.69 113.68 179.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 63.4 m -60.43 -38.76 85.11 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.619 -0.432 . . . . 1.63 110.351 -178.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 543' ' ' ASN . . . . . 0.414 ' O ' HG12 ' B' ' 547' ' ' ILE . 42.1 t30 -69.0 -47.14 66.23 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.316 1.228 . . . . 2.41 114.316 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 544' ' ' ILE . . . . . . . . . . . . . 57.6 mt -52.64 -45.96 48.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.471 -0.937 . . . . 2.23 108.471 170.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 545' ' ' MET . . . . . 0.697 ' HB3' HG22 ' B' ' 587' ' ' THR . 50.6 mtp -64.05 -42.24 97.11 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 119.718 -0.793 . . . . 3.06 112.828 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -58.37 -48.8 79.42 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 119.272 -0.971 . . . . 2.36 109.829 176.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 547' ' ' ILE . . . . . 0.505 ' O ' ' HG2' ' B' ' 550' ' ' GLN . 43.2 mm -55.06 -61.36 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.854 0.687 . . . . 2.07 112.854 179.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 548' ' ' VAL . . . . . 0.595 HG21 HD12 ' B' ' 555' ' ' LEU . 12.4 p -47.41 -44.23 9.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 C-N-CA 119.892 -0.723 . . . . 2.03 111.388 176.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.32 -28.1 58.68 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.799 -0.563 . . . . 0.0 112.916 -177.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 550' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' B' ' 547' ' ' ILE . 7.5 pt20 -87.08 -9.55 55.12 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.598 0.592 . . . . 2.85 112.598 -175.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -120.38 59.69 6.99 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.773 1.027 . . . . 3.84 113.773 -176.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 552' ' ' PRO . . . . . 0.438 ' HD3' ' C ' ' B' ' 550' ' ' GLN . 44.6 Cg_exo -55.96 -39.35 91.72 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.068 0.509 . . . . 0.89 113.139 177.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -56.32 -46.67 79.77 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.153 0.501 . . . . 4.49 109.968 -174.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -48.93 -59.79 3.3 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 123.956 0.902 . . . . 1.05 112.113 167.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 555' ' ' LEU . . . . . 0.595 HD12 HG21 ' B' ' 548' ' ' VAL . 77.4 mt -54.33 -48.6 71.2 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.281 -0.418 . . . . 2.09 110.17 -178.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . 0.417 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 46.5 ttp180 -53.91 -35.9 62.14 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.752 1.019 . . . . 3.63 113.752 -178.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.05 -12.13 51.02 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.513 -0.475 . . . . 1.0 112.08 -177.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 558' ' ' HIS . . . . . 0.471 ' ND1' ' HB2' ' B' ' 561' ' ' PHE . 18.7 t-160 -128.28 78.45 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.399 1.259 . . . . 3.8 114.399 -177.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 559' ' ' TRP . . . . . 0.564 ' HB2' ' NE2' ' B' ' 603' ' ' GLN . 17.2 p90 -50.39 -48.3 56.02 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 116.613 2.079 . . . . 3.87 116.613 -176.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 24.1 ttmm -56.6 -36.69 69.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.265 -0.425 . . . . 3.79 111.073 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 561' ' ' PHE . . . . . 0.525 ' O ' HG11 ' B' ' 565' ' ' VAL . 0.1 OUTLIER -74.91 -45.08 45.02 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.061 -1.055 . . . . 1.8 111.897 175.68 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . 0.49 ' O ' HG23 ' B' ' 565' ' ' VAL . 6.4 tt -49.94 -59.12 4.17 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 122.459 0.304 . . . . 1.94 110.338 175.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -50.22 -38.64 41.31 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.863 1.061 . . . . 3.16 113.863 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 37.8 m -71.81 -39.42 69.86 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.487 0.66 . . . . 1.88 110.294 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 565' ' ' VAL . . . . . 0.525 HG11 ' O ' ' B' ' 561' ' ' PHE . 4.8 m -62.85 -41.28 91.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.687 -0.688 . . . . 1.81 112.529 173.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 566' ' ' VAL . . . . . 0.565 HG23 HD11 ' B' ' 591' ' ' ILE . 47.9 t -71.06 -50.84 39.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 C-N-CA 120.537 -0.465 . . . . 2.0 110.798 -176.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -51.04 -37.42 45.26 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.035 -0.53 . . . . 2.53 112.067 170.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -72.72 -32.58 65.82 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.736 -0.468 . . . . 3.93 109.736 -179.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 569' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' B' ' 565' ' ' VAL . 71.3 mt -67.52 -36.53 81.23 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 108.648 -0.871 . . . . 2.53 108.648 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -65.29 -39.34 92.42 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.915 -0.402 . . . . 4.72 109.915 178.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.68 -53.58 56.63 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 120.011 -0.676 . . . . 2.47 110.465 176.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 572' ' ' PHE . . . . . 0.53 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 23.5 m-85 -62.44 -9.9 9.91 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.121 1.156 . . . . 1.87 114.121 -177.135 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 573' ' ' MET . . . . . 0.549 ' HB3' HD21 ' B' ' 625' ' ' LEU . 67.9 mtt -76.39 -5.34 46.86 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.648 0.737 . . . . 2.56 109.641 178.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -109.43 -0.57 18.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.815 -1.084 . . . . 4.11 111.431 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 575' ' ' GLU . . . . . 0.535 ' HB3' HG21 ' B' ' 580' ' ' VAL . 48.4 mm-40 -68.59 130.24 42.26 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 116.195 -0.457 . . . . 1.57 110.124 177.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 64.0 p -87.89 -21.21 25.1 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.026 0.75 . . . . 2.01 113.026 -177.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 577' ' ' HIS . . . . . 0.461 ' O ' HG23 ' B' ' 580' ' ' VAL . 64.7 t-80 -60.21 128.0 34.62 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.402 0.62 . . . . 3.71 112.528 -175.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -44.85 125.86 5.33 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.397 -0.82 . . . . 2.15 113.139 -171.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.72 4.76 Favored Glycine 0 C--O 1.223 -0.567 0 N-CA-C 116.299 1.28 . . . . 0.0 116.299 175.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 580' ' ' VAL . . . . . 0.535 HG21 ' HB3' ' B' ' 575' ' ' GLU . 23.5 m -53.81 -46.31 63.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.096 0.776 . . . . 1.89 113.096 -175.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -59.67 -42.3 92.56 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.371 0.508 . . . . 2.46 112.371 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -60.54 -42.4 96.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 112.232 0.456 . . . . 2.23 112.232 172.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 7.2 tpt -60.68 -49.51 77.21 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.084 -0.246 . . . . 3.01 110.453 175.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.7 -43.0 80.11 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.129 -0.487 . . . . 1.01 111.81 -177.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 50.2 t -74.35 -40.93 61.82 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.03 -0.668 . . . . 2.2 112.004 -177.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 586' ' ' ASP . . . . . 0.493 ' O ' HG21 ' B' ' 589' ' ' ILE . 0.7 OUTLIER -59.6 -46.29 89.4 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.249 -0.432 . . . . 1.98 111.974 -179.899 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 587' ' ' THR . . . . . 0.697 HG22 ' HB3' ' B' ' 545' ' ' MET . 41.7 p -62.23 -41.23 98.23 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.372 0.669 . . . . 1.92 110.358 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 588' ' ' PHE . . . . . 0.531 ' HA ' HG12 ' B' ' 591' ' ' ILE . 88.2 t80 -61.46 -32.15 72.14 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.118 -0.492 . . . . 0.72 111.186 -177.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 589' ' ' ILE . . . . . 0.493 HG21 ' O ' ' B' ' 586' ' ' ASP . 20.1 tt -79.87 -35.95 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.878 -1.929 . . . . 2.46 109.8 -175.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -57.56 -49.86 74.99 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 107.779 -1.193 . . . . 3.09 107.779 176.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . 0.565 HD11 HG23 ' B' ' 566' ' ' VAL . 34.5 pt -63.91 -43.64 97.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.784 0.661 . . . . 2.43 112.784 -176.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . 0.477 ' N ' HG13 ' B' ' 591' ' ' ILE . . . -63.94 -39.17 93.53 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.535 -0.466 . . . . 1.01 112.217 177.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 593' ' ' GLN . . . . . 0.463 HE21 ' HA ' ' B' ' 593' ' ' GLN . 0.0 OUTLIER -62.3 -70.14 0.22 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.14 -1.024 . . . . 2.88 109.795 174.518 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -56.13 -23.72 36.28 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 116.623 2.082 . . . . 2.67 116.623 -176.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 74.8 m -121.66 25.15 9.44 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 114.331 1.234 . . . . 1.97 114.331 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -48.5 -38.52 20.4 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.887 1.81 . . . . 4.07 115.887 -172.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . 0.418 ' O ' ' HG2' ' B' ' 601' ' ' GLN . 34.5 ttm180 -69.56 -32.63 71.52 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.242 0.831 . . . . 4.32 113.242 -175.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 598' ' ' HIS . . . . . 0.417 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 57.2 m-70 -70.07 -3.84 18.37 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.595 -0.73 . . . . 2.88 112.107 -173.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -105.54 -16.88 14.59 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 123.597 0.561 . . . . 3.7 110.231 -176.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 35.8 m -105.9 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.11 -0.95 . . . . 2.05 111.276 -175.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 601' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 3.9 pt20 -102.05 139.52 37.57 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 119.563 -0.855 . . . . 2.81 111.561 176.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 7.4 m -60.95 122.74 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.597 -0.89 . . . . 1.99 108.597 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 603' ' ' GLN . . . . . 0.564 ' NE2' ' HB2' ' B' ' 559' ' ' TRP . 18.9 pt20 -92.79 167.31 11.95 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.631 0.582 . . . . 3.39 110.048 -177.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 41.3 t -71.99 129.01 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 N-CA-C 112.958 0.725 . . . . 1.91 112.958 -175.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.35 6.52 64.44 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.059 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 606' ' ' GLU . . . . . 0.501 ' HG3' ' H ' ' B' ' 608' ' ' MET . 8.7 tp10 -131.44 157.97 42.06 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.639 -0.825 . . . . 2.51 110.808 175.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 607' ' ' VAL . . . . . 0.518 HG12 ' HG2' ' B' ' 608' ' ' MET . 13.9 p -103.26 -22.46 4.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.097 -0.956 . . . . 2.03 112.49 -175.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 608' ' ' MET . . . . . 0.518 ' HG2' HG12 ' B' ' 607' ' ' VAL . 22.2 mmt -137.02 142.22 37.57 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.601 0.593 . . . . 3.15 112.601 -174.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 609' ' ' PRO . . . . . 0.533 ' HB2' HG23 ' B' ' 611' ' ' ILE . 9.7 Cg_endo -52.08 130.9 36.93 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.85 112.131 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -57.0 -31.84 65.5 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 111.823 0.305 . . . . 3.05 111.823 -174.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 611' ' ' ILE . . . . . 0.533 HG23 ' HB2' ' B' ' 609' ' ' PRO . 14.0 tt -50.0 -44.93 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 CA-C-O 120.816 0.341 . . . . 2.38 110.496 178.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -49.88 -52.0 36.23 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.646 0.778 . . . . 2.15 112.875 177.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -59.95 -37.13 78.67 Favored 'General case' 0 C--O 1.244 0.795 0 C-N-CA 120.59 -0.444 . . . . 2.66 110.189 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 614' ' ' ILE . . . . . 0.401 ' O ' ' ND2' ' B' ' 617' ' ' ASN . 73.0 mt -64.45 -48.05 86.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 C-N-CA 120.262 -0.575 . . . . 2.28 111.973 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 59.8 tp -62.6 -31.13 71.91 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.03 0.752 . . . . 2.38 113.03 -177.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -79.6 2.16 23.4 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.639 1.348 . . . . 2.62 114.639 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 617' ' ' ASN . . . . . 0.595 ' C ' HD21 ' B' ' 617' ' ' ASN . 0.2 OUTLIER -142.42 15.67 2.02 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.117 0.784 . . . . 2.63 113.117 -174.283 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 618' ' ' ILE . . . . . 0.43 ' O ' HG12 ' B' ' 621' ' ' ILE . 13.5 tt -46.87 -46.98 8.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.47 110.263 -176.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 619' ' ' ASN . . . . . 0.411 ' N ' HG22 ' B' ' 618' ' ' ILE . 22.7 p-10 -63.24 -51.06 67.74 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.754 1.02 . . . . 2.98 113.754 -176.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 620' ' ' THR . . . . . 0.41 ' OG1' ' HB2' ' B' ' 617' ' ' ASN . 56.8 p -56.94 -31.9 65.43 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.46 -0.896 . . . . 1.94 110.741 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 621' ' ' ILE . . . . . 0.455 HG13 HG21 ' B' ' 622' ' ' ILE . 32.0 pt -79.27 -42.65 23.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.373 1.62 . . . . 2.57 115.373 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 622' ' ' ILE . . . . . 0.455 HG21 HG13 ' B' ' 621' ' ' ILE . 34.7 pt -87.67 -6.25 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 115.069 1.507 . . . . 2.61 115.069 -177.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 40.2 t -19.98 -58.32 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.567 2.062 . . . . 2.06 116.567 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.23 -7.65 26.16 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.037 -1.438 . . . . 2.07 110.994 -163.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 625' ' ' LEU . . . . . 0.549 HD21 ' HB3' ' B' ' 573' ' ' MET . 82.7 mt -71.78 146.9 47.78 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 123.311 0.382 . . . . 2.24 111.773 -173.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 626' ' ' GLN . . . . . 0.545 ' HB3' ' HD2' ' B' ' 627' ' ' PRO . 97.2 mt-30 -76.75 162.1 71.64 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 108.827 -0.805 . . . . 2.99 108.827 174.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 627' ' ' PRO . . . . . 0.545 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 6.3 Cg_endo -47.85 -43.55 29.14 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.823 1.432 . . . . 0.86 115.823 -178.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -67.32 -43.08 82.52 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.615 -0.513 . . . . 3.24 109.615 -174.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -63.29 -38.29 90.58 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.951 -0.568 . . . . 2.79 110.9 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 630' ' ' VAL . . . . . . . . . . . . . 80.9 t . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.237 -0.887 . . . . 1.93 110.67 176.746 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 504' ' ' ILE . . . . . 0.648 ' H2 ' HD12 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.277 0 N-CA-C 113.094 0.776 . . . . 2.63 113.094 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 74.9 m -48.84 119.11 2.94 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.519 0.563 . . . . 1.82 112.519 174.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.79 1.5 67.86 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 120.948 -0.644 . . . . 0.0 114.501 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.4 -7.57 41.21 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 117.549 0.674 . . . . 1.02 112.444 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 24.8 mmt -112.43 159.98 18.2 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.22 0.533 . . . . 2.72 112.262 174.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -69.64 134.28 48.53 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 109.051 -0.722 . . . . 3.51 109.051 174.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.78 -35.39 0.79 Allowed 'General case' 0 C--O 1.239 0.533 0 N-CA-C 113.37 0.878 . . . . 2.66 113.37 -173.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -73.82 -41.88 61.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.531 -0.759 . . . . 2.44 112.1 -176.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -64.85 -40.18 94.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.182 0.515 . . . . 2.08 110.873 171.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -53.7 -48.61 69.38 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.285 -0.87 . . . . 1.92 111.107 177.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 514' ' ' LYS . . . . . 0.603 ' HB3' ' HZ2' ' B' ' 514' ' ' LYS . 9.9 mtpm? -54.86 -57.67 10.66 Favored 'General case' 0 C--O 1.241 0.65 0 N-CA-C 111.889 0.329 . . . . 3.15 111.889 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -56.63 -35.85 68.81 Favored 'General case' 0 CA--C 1.504 -0.817 0 O-C-N 124.129 0.893 . . . . 4.26 111.138 -177.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -76.15 -45.63 32.62 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.151 -0.932 . . . . 2.37 110.515 -173.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 517' ' ' LEU . . . . . 0.518 ' HA ' HG13 ' B' ' 520' ' ' VAL . 8.2 tt -66.68 -32.26 73.46 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.761 -0.654 . . . . 2.46 112.64 177.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 518' ' ' VAL . . . . . . . . . . . . . 44.6 t -67.47 -35.1 72.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 118.515 -1.274 . . . . 2.02 109.081 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 75.9 p -72.93 -36.42 67.22 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.451 0.643 . . . . 1.82 112.42 178.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 520' ' ' VAL . . . . . 0.518 HG13 ' HA ' ' B' ' 517' ' ' LEU . 9.8 p -71.18 -42.36 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 O-C-N 122.094 -0.379 . . . . 1.86 111.673 -174.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 521' ' ' ILE . . . . . 0.483 HG12 ' O ' ' B' ' 517' ' ' LEU . 26.2 pt -90.64 -25.8 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.442 1.645 . . . . 2.46 115.442 -175.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -60.82 -35.21 75.95 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.657 -0.868 . . . . 2.99 108.657 173.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -92.43 -21.46 20.18 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.987 1.477 . . . . 2.17 114.987 -177.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 84.3 mt -70.6 -45.46 65.27 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 109.275 -0.639 . . . . 2.08 109.275 169.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . 0.57 HD22 HD11 ' B' ' 544' ' ' ILE . 3.7 mm? -52.16 -45.46 65.08 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.28 0.562 . . . . 2.48 110.97 169.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.5 -40.59 94.34 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 -178.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -63.57 -36.12 82.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 2.2 111.47 175.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 44.1 t -63.55 -47.6 80.9 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.041 -0.527 . . . . 1.05 110.709 -175.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -61.78 -29.57 70.23 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.518 -0.764 . . . . 2.5 112.585 173.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -71.64 -54.76 9.35 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.358 0.873 . . . . 2.83 113.358 -177.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -68.77 137.97 54.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.97 -0.559 . . . . 2.73 111.002 -177.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 532' ' ' ARG . . . . . 0.425 ' HG2' ' N ' ' B' ' 533' ' ' GLY . 52.6 ttt180 -96.43 160.74 14.25 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.773 -0.649 . . . . 4.81 110.208 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 533' ' ' GLY . . . . . 0.425 ' N ' ' HG2' ' B' ' 532' ' ' ARG . . . 87.46 119.63 1.36 Allowed Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 115.982 -0.554 . . . . 0.0 113.954 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 534' ' ' LYS . . . . . 0.664 ' HD3' ' H ' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.04 -36.72 8.31 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.172 0.804 . . . . 3.36 113.172 177.234 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -50.61 -51.8 45.33 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.868 -0.52 . . . . 2.2 110.809 174.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 536' ' ' ASN . . . . . 0.45 ' O ' HG23 ' B' ' 539' ' ' ILE . 40.0 m-80 -66.13 -44.77 83.26 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.603 0.594 . . . . 2.09 112.603 178.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 537' ' ' LYS . . . . . 0.534 ' HA ' HG22 ' B' ' 540' ' ' ILE . 96.8 mttt -67.88 -31.95 72.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.427 -0.509 . . . . 2.93 110.331 -174.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.08 -46.97 69.53 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.822 -0.626 . . . . 1.02 111.149 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 539' ' ' ILE . . . . . 0.536 HG22 ' N ' ' B' ' 540' ' ' ILE . 10.2 tp -58.1 -54.99 24.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 121.542 0.687 . . . . 2.34 111.26 173.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 540' ' ' ILE . . . . . 0.536 ' N ' HG22 ' B' ' 539' ' ' ILE . 10.0 tp -56.83 -48.07 81.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 121.672 -0.642 . . . . 2.37 110.581 -178.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 541' ' ' ALA . . . . . 0.41 ' N ' HG21 ' B' ' 540' ' ' ILE . . . -57.55 -44.03 84.9 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 113.545 0.943 . . . . 0.69 113.545 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 542' ' ' SER . . . . . 0.513 ' HB2' ' HE1' ' B' ' 583' ' ' MET . 96.0 p -60.47 -38.72 85.14 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.625 -0.43 . . . . 1.63 110.297 -178.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 543' ' ' ASN . . . . . 0.43 ' O ' HG12 ' B' ' 547' ' ' ILE . 27.4 t-20 -69.08 -47.08 66.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 114.339 1.237 . . . . 2.41 114.339 -175.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 544' ' ' ILE . . . . . 0.57 HD11 HD22 ' B' ' 525' ' ' LEU . 45.2 mt -52.71 -45.88 49.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.479 -0.934 . . . . 2.23 108.479 170.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 545' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -64.02 -42.32 97.14 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.778 -0.769 . . . . 3.06 112.766 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -58.33 -48.81 79.34 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 119.234 -0.986 . . . . 2.36 109.845 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 547' ' ' ILE . . . . . 0.43 HG12 ' O ' ' B' ' 543' ' ' ASN . 44.8 mm -55.06 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.77 0.656 . . . . 2.07 112.77 179.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 548' ' ' VAL . . . . . 0.496 HG11 HD13 ' B' ' 555' ' ' LEU . 86.4 t -47.37 -44.22 8.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 C-N-CA 119.837 -0.745 . . . . 2.03 111.454 176.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.41 -28.08 58.9 Favored Glycine 0 C--O 1.237 0.319 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -87.06 -9.48 55.35 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.571 0.582 . . . . 2.85 112.571 -175.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -120.4 59.64 7.0 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 113.79 1.033 . . . . 3.84 113.79 -176.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -56.04 -39.3 92.05 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 O-C-N 122.189 0.573 . . . . 0.89 113.132 178.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -56.39 -46.66 80.01 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 121.074 0.464 . . . . 4.49 109.924 -174.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -48.9 -59.75 3.33 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 123.896 0.879 . . . . 1.05 112.125 167.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 555' ' ' LEU . . . . . 0.541 ' HB3' HD13 ' B' ' 562' ' ' LEU . 83.8 mt -54.38 -48.58 71.36 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.304 -0.407 . . . . 2.09 110.158 -178.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . 0.449 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 76.8 ttt180 -53.83 -35.91 61.97 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 113.814 1.042 . . . . 3.63 113.814 -178.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.09 -12.13 50.91 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.486 -0.486 . . . . 1.0 112.08 -177.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 558' ' ' HIS . . . . . 0.54 ' HE2' ' HE2' ' B' ' 514' ' ' LYS . 94.7 m-70 -128.28 78.48 1.84 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.405 1.261 . . . . 3.8 114.405 -177.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 559' ' ' TRP . . . . . 0.546 ' HB2' HE21 ' B' ' 603' ' ' GLN . 38.8 p90 -50.55 -48.25 57.48 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.505 2.039 . . . . 3.87 116.505 -176.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 560' ' ' LYS . . . . . 0.599 ' HZ3' ' HB2' ' B' ' 560' ' ' LYS . 0.1 OUTLIER -56.66 -36.62 69.76 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.378 -0.374 . . . . 3.79 111.132 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 561' ' ' PHE . . . . . 0.467 ' O ' HG23 ' B' ' 565' ' ' VAL . 0.6 OUTLIER -74.9 -45.13 44.83 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 119.16 -1.016 . . . . 1.8 111.952 175.575 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . 0.541 HD13 ' HB3' ' B' ' 555' ' ' LEU . 58.5 tp -49.94 -59.22 4.07 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 122.428 0.291 . . . . 1.94 110.264 174.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 563' ' ' LYS . . . . . 0.612 ' HZ2' ' HB2' ' B' ' 563' ' ' LYS . 10.2 mtmp? -50.11 -38.73 40.23 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.835 1.05 . . . . 3.16 113.835 178.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 87.4 m -71.75 -39.35 70.09 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.553 0.692 . . . . 1.88 110.429 -176.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 565' ' ' VAL . . . . . 0.467 HG23 ' O ' ' B' ' 561' ' ' PHE . 67.2 t -62.92 -41.15 91.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.618 -0.719 . . . . 1.81 112.551 173.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 566' ' ' VAL . . . . . 0.423 HG13 ' CE2' ' B' ' 570' ' ' PHE . 43.1 t -71.08 -50.89 39.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 120.546 -0.462 . . . . 2.0 110.819 -176.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -51.1 -37.39 45.58 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.951 -0.568 . . . . 2.53 112.029 170.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -72.6 -32.77 66.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.67 -0.493 . . . . 3.93 109.67 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 569' ' ' LEU . . . . . 0.62 HD13 ' HB1' ' B' ' 584' ' ' ALA . 1.8 tm? -67.44 -36.46 81.26 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.739 -0.837 . . . . 2.53 108.739 177.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 570' ' ' PHE . . . . . 0.46 ' HD1' ' HE3' ' B' ' 573' ' ' MET . 24.6 m-85 -65.41 -39.31 92.0 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.863 -0.421 . . . . 4.72 109.863 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -57.67 -53.56 56.78 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 119.908 -0.717 . . . . 2.47 110.479 176.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -62.36 -10.03 10.02 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.108 1.151 . . . . 1.87 114.108 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 573' ' ' MET . . . . . 0.648 ' HB3' HD11 ' B' ' 625' ' ' LEU . 18.0 mtm -76.35 -5.34 46.74 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.616 0.722 . . . . 2.56 109.641 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 29.6 m-70 -109.42 -0.61 18.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.815 -1.084 . . . . 4.11 111.452 173.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 575' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -68.51 130.2 42.18 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.212 -0.449 . . . . 1.57 110.083 177.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 7.9 t -87.81 -21.32 25.14 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.027 0.751 . . . . 2.01 113.027 -177.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -60.19 128.02 34.71 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.409 0.623 . . . . 3.71 112.532 -175.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -44.89 125.91 5.4 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.315 -0.857 . . . . 2.15 113.011 -171.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.76 4.74 Favored Glycine 0 C--O 1.222 -0.643 0 N-CA-C 116.323 1.289 . . . . 0.0 116.323 174.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 45.2 t -53.72 -46.37 62.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 113.186 0.81 . . . . 1.89 113.186 -175.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.551 ' HB2' HE22 ' B' ' 629' ' ' GLN . 3.3 pt20 -59.63 -42.31 92.43 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.384 0.513 . . . . 2.46 112.384 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -60.46 -42.45 96.22 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.168 0.433 . . . . 2.23 112.168 172.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 583' ' ' MET . . . . . 0.513 ' HE1' ' HB2' ' B' ' 542' ' ' SER . 37.1 tpp -60.74 -49.42 77.59 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 121.027 -0.269 . . . . 3.01 110.431 175.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 584' ' ' ALA . . . . . 0.62 ' HB1' HD13 ' B' ' 569' ' ' LEU . . . -56.85 -42.96 80.65 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.162 -0.472 . . . . 1.01 111.692 -177.159 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 52.6 t -74.36 -40.93 61.8 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 120.041 -0.664 . . . . 2.2 111.943 -177.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 586' ' ' ASP . . . . . 0.447 ' O ' HG23 ' B' ' 589' ' ' ILE . 15.5 t70 -59.7 -46.26 89.63 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.312 -0.404 . . . . 1.98 111.935 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 46.8 m -62.15 -41.23 98.09 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.433 0.693 . . . . 1.92 110.39 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 588' ' ' PHE . . . . . 0.586 ' HB2' HD12 ' B' ' 569' ' ' LEU . 87.8 t80 -61.5 -32.17 72.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.075 -0.511 . . . . 0.72 111.142 -177.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 589' ' ' ILE . . . . . 0.447 HG23 ' O ' ' B' ' 586' ' ' ASP . 8.9 tp -79.95 -35.91 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.847 -1.941 . . . . 2.46 109.854 -175.42 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . 0.619 ' HZ3' ' HB3' ' B' ' 590' ' ' LYS . 3.7 mmmp? -57.46 -49.99 74.49 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 107.747 -1.205 . . . . 3.09 107.747 176.025 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 87.8 mt -63.83 -43.76 97.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.725 -0.671 . . . . 2.43 112.739 -176.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.14 93.45 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.512 -0.475 . . . . 1.01 112.244 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -62.26 -70.19 0.21 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.222 -0.991 . . . . 2.88 109.796 174.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -56.1 -23.86 36.72 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.562 2.06 . . . . 2.67 116.562 -176.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 75.0 m -121.68 25.24 9.38 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.261 1.208 . . . . 1.97 114.261 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -48.48 -38.54 20.32 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.861 1.8 . . . . 4.07 115.861 -172.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -69.56 -32.66 71.57 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.186 0.809 . . . . 4.32 113.186 -175.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 598' ' ' HIS . . . . . 0.449 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 55.1 m-70 -70.12 -3.85 18.6 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.617 -0.72 . . . . 2.88 112.072 -173.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -105.58 -16.93 14.57 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.585 0.553 . . . . 3.7 110.228 -176.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 46.5 t -105.82 -24.39 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.017 -0.992 . . . . 2.05 111.295 -175.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -101.99 139.5 37.54 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.547 -0.861 . . . . 2.81 111.599 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 4.3 p -60.91 122.7 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 N-CA-C 108.599 -0.889 . . . . 1.99 108.599 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 603' ' ' GLN . . . . . 0.546 HE21 ' HB2' ' B' ' 559' ' ' TRP . 5.1 mt-30 -92.68 167.3 11.99 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.706 0.629 . . . . 3.39 110.138 -177.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.01 129.08 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 C-N-CA 119.881 -0.728 . . . . 1.91 112.907 -175.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.26 6.58 64.55 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.069 -175.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 606' ' ' GLU . . . . . 0.522 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.1 tp10 -131.46 158.03 41.92 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.611 -0.836 . . . . 2.51 110.78 175.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 33.3 m -103.24 -22.58 4.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.13 -0.941 . . . . 2.03 112.582 -175.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 608' ' ' MET . . . . . 0.522 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 23.2 ptt? -136.92 142.25 37.89 Favored Pre-proline 0 C--O 1.223 -0.297 0 N-CA-C 112.611 0.597 . . . . 3.15 112.611 -174.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.08 130.89 36.92 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.85 112.131 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -57.01 -31.87 65.55 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.792 0.293 . . . . 3.05 111.792 -174.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 611' ' ' ILE . . . . . . . . . . . . . 11.8 tt -50.05 -44.8 22.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.85 0.357 . . . . 2.38 110.56 178.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -49.92 -52.01 36.57 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.623 0.769 . . . . 2.15 112.906 177.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -59.84 -37.17 78.47 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 120.604 -0.438 . . . . 2.66 110.223 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 31.9 mm -64.55 -47.98 86.87 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.181 -0.607 . . . . 2.28 111.922 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 8.4 tt -62.63 -31.11 71.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.98 0.733 . . . . 2.38 112.98 -177.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -79.57 2.15 23.36 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.61 1.337 . . . . 2.62 114.61 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -142.41 15.66 2.02 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 113.103 0.779 . . . . 2.63 113.103 -174.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 618' ' ' ILE . . . . . 0.504 HG12 ' N ' ' B' ' 619' ' ' ASN . 0.2 OUTLIER -47.0 -46.98 8.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 C-N-CA 118.957 -1.097 . . . . 2.47 110.183 -176.663 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 619' ' ' ASN . . . . . 0.504 ' N ' HG12 ' B' ' 618' ' ' ILE . 6.0 p30 -63.19 -51.11 67.65 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.759 1.022 . . . . 2.98 113.759 -176.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 76.3 p -56.85 -31.88 65.23 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 119.449 -0.9 . . . . 1.94 110.804 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 621' ' ' ILE . . . . . 0.55 HG13 HG12 ' B' ' 622' ' ' ILE . 42.0 pt -79.35 -42.62 23.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.322 1.601 . . . . 2.57 115.322 -179.003 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 622' ' ' ILE . . . . . 0.55 HG12 HG13 ' B' ' 621' ' ' ILE . 19.7 mm -87.72 -6.26 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 115.035 1.494 . . . . 2.61 115.035 -177.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.6 t -19.98 -58.29 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.567 2.062 . . . . 2.06 116.567 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -99.27 -7.58 26.18 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.063 -1.426 . . . . 2.07 111.022 -163.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 625' ' ' LEU . . . . . 0.648 HD11 ' HB3' ' B' ' 573' ' ' MET . 8.3 mp -71.83 146.82 47.74 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.409 -0.36 . . . . 2.24 111.7 -173.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 626' ' ' GLN . . . . . 0.472 ' O ' HG11 ' B' ' 630' ' ' VAL . 18.9 pt20 -76.65 162.13 71.68 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 108.814 -0.81 . . . . 2.99 108.814 174.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 627' ' ' PRO . . . . . 0.545 ' O ' HG22 ' B' ' 630' ' ' VAL . 79.4 Cg_exo -47.96 -43.51 29.86 Favored 'Trans proline' 0 C--O 1.233 0.263 0 N-CA-C 115.827 1.434 . . . . 0.86 115.827 -178.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 628' ' ' GLN . . . . . 0.448 ' NE2' ' HB2' ' B' ' 627' ' ' PRO . 2.0 mp0 -67.33 -43.01 82.65 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.602 -0.518 . . . . 3.24 109.602 -174.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 629' ' ' GLN . . . . . 0.551 HE22 ' HB2' ' B' ' 581' ' ' GLN . 28.9 mt-30 -63.23 -38.34 90.8 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.944 -0.571 . . . . 2.79 110.928 178.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 630' ' ' VAL . . . . . 0.545 HG22 ' O ' ' B' ' 627' ' ' PRO . 1.0 OUTLIER . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.213 -0.898 . . . . 1.93 110.669 176.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 504' ' ' ILE . . . . . 0.663 HG13 ' HB1' ' B' ' 507' ' ' ALA . 8.0 tp . . . . . 0 C--O 1.236 0.342 0 N-CA-C 112.985 0.735 . . . . 2.63 112.985 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 505' ' ' SER . . . . . 0.44 ' HB3' ' HG2' ' B' ' 550' ' ' GLN . 79.5 p -48.9 119.16 3.0 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.553 0.575 . . . . 1.82 112.553 174.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.86 1.38 67.78 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.92 -0.657 . . . . 0.0 114.407 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 507' ' ' ALA . . . . . 0.663 ' HB1' HG13 ' B' ' 504' ' ' ILE . . . -94.26 -7.6 41.55 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 117.677 0.738 . . . . 1.02 112.48 176.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 26.4 mmt -112.47 159.93 18.27 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.107 -0.497 . . . . 2.72 112.269 174.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -69.7 134.24 48.43 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 109.14 -0.689 . . . . 3.51 109.14 174.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 510' ' ' GLU . . . . . 0.479 ' HG2' ' HE2' ' B' ' 514' ' ' LYS . 40.6 tt0 -41.65 -35.43 0.76 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 113.375 0.88 . . . . 2.66 113.375 -173.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.73 -42.03 61.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.621 -0.718 . . . . 2.44 112.118 -176.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -64.84 -40.1 94.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.129 0.49 . . . . 2.08 110.855 171.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -53.72 -48.65 69.39 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.369 -0.832 . . . . 1.92 111.183 177.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 514' ' ' LYS . . . . . 0.479 ' HE2' ' HG2' ' B' ' 510' ' ' GLU . 66.3 mttm -54.84 -57.56 11.1 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 111.93 0.345 . . . . 3.15 111.93 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -56.66 -35.84 68.86 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 124.157 0.911 . . . . 4.26 111.116 -177.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -76.26 -45.51 32.35 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.121 -0.945 . . . . 2.37 110.502 -173.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 517' ' ' LEU . . . . . 0.485 ' O ' HG12 ' B' ' 520' ' ' VAL . 91.0 mt -66.77 -32.25 73.41 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.757 -0.656 . . . . 2.46 112.596 177.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 518' ' ' VAL . . . . . 0.443 HG21 ' O ' ' B' ' 514' ' ' LYS . 78.5 t -67.45 -35.15 72.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 118.495 -1.282 . . . . 2.02 109.021 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 41.4 p -72.98 -36.26 67.04 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.311 0.577 . . . . 1.82 112.401 178.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 520' ' ' VAL . . . . . 0.485 HG12 ' O ' ' B' ' 517' ' ' LEU . 9.3 p -71.3 -42.37 74.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 116.48 -0.327 . . . . 1.86 111.588 -174.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 521' ' ' ILE . . . . . 0.455 HG22 HG11 ' B' ' 520' ' ' VAL . 15.5 pt -90.57 -25.82 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 115.455 1.65 . . . . 2.46 115.455 -175.135 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 34.1 ttmt -60.89 -35.16 75.91 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.682 -0.858 . . . . 2.99 108.682 173.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -92.45 -21.49 20.15 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 114.988 1.477 . . . . 2.17 114.988 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 77.5 mt -70.6 -45.36 65.44 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.295 -0.631 . . . . 2.08 109.295 168.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 83.9 mt -52.3 -45.45 65.54 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.222 0.534 . . . . 2.48 110.942 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.5 -40.54 94.34 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 73.4 mt -63.52 -36.18 82.94 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.033 0.444 . . . . 2.2 111.437 175.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 42.3 t -63.47 -47.83 80.19 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.082 -0.508 . . . . 1.05 110.63 -175.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.64 -29.6 70.16 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.438 -0.801 . . . . 2.5 112.616 173.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -71.72 -54.65 9.59 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.341 0.867 . . . . 2.83 113.341 -177.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 17.1 tptp -68.76 137.95 54.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.008 -0.542 . . . . 2.73 111.031 -177.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 532' ' ' ARG . . . . . 0.439 ' HA ' ' HZ3' ' B' ' 537' ' ' LYS . 16.3 ptp180 -96.43 160.72 14.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.765 -0.652 . . . . 4.81 110.19 178.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.39 119.58 1.34 Allowed Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.918 -0.583 . . . . 0.0 114.018 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -46.99 -36.71 8.07 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.187 0.81 . . . . 3.36 113.187 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -50.53 -51.86 43.95 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 120.337 -0.545 . . . . 2.2 110.799 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 -66.09 -44.82 83.3 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.621 0.601 . . . . 2.09 112.621 178.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 537' ' ' LYS . . . . . 0.439 ' HZ3' ' HA ' ' B' ' 532' ' ' ARG . 63.1 mttp -67.8 -32.08 72.39 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.468 -0.493 . . . . 2.93 110.258 -174.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.1 -46.93 69.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.835 -0.62 . . . . 1.02 111.117 178.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 45.4 mm -58.15 -54.97 25.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 121.622 0.725 . . . . 2.34 111.315 173.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 540' ' ' ILE . . . . . . . . . . . . . 82.8 mt -56.73 -48.19 81.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.663 -0.648 . . . . 2.37 110.592 -178.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.43 -44.05 84.35 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.577 0.954 . . . . 0.69 113.577 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 542' ' ' SER . . . . . 0.506 ' HB2' ' HE2' ' B' ' 583' ' ' MET . 88.9 p -60.5 -38.78 85.43 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.571 -0.451 . . . . 1.63 110.297 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -68.96 -47.09 66.5 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.407 1.262 . . . . 2.41 114.407 -175.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 544' ' ' ILE . . . . . 0.49 ' HA ' HG12 ' B' ' 547' ' ' ILE . 61.2 mt -52.67 -45.89 49.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.539 -0.912 . . . . 2.23 108.539 170.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 545' ' ' MET . . . . . 0.701 ' HB3' HG22 ' B' ' 587' ' ' THR . 0.2 OUTLIER -64.08 -42.31 97.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.693 -0.803 . . . . 3.06 112.825 179.389 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -58.19 -48.84 79.06 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 119.197 -1.001 . . . . 2.36 109.962 176.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 547' ' ' ILE . . . . . 0.49 HG12 ' HA ' ' B' ' 544' ' ' ILE . 38.1 pt -55.02 -61.43 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.856 0.687 . . . . 2.07 112.856 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 548' ' ' VAL . . . . . 0.442 ' H ' HG13 ' B' ' 547' ' ' ILE . 10.2 p -47.3 -44.26 8.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 C-N-CA 119.784 -0.767 . . . . 2.03 111.446 176.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.37 -28.07 58.8 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.823 -0.548 . . . . 0.0 112.976 -177.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 550' ' ' GLN . . . . . 0.44 ' HG2' ' HB3' ' B' ' 505' ' ' SER . 47.3 tt0 -87.01 -9.55 55.27 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 112.601 0.593 . . . . 2.85 112.601 -175.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -120.48 59.72 7.2 Favored Pre-proline 0 CA--C 1.536 0.44 0 N-CA-C 113.792 1.034 . . . . 3.84 113.792 -176.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -55.97 -39.34 91.78 Favored 'Trans proline' 0 C--O 1.222 -0.311 0 O-C-N 122.122 0.538 . . . . 0.89 113.246 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 17.0 tpp180 -56.35 -46.66 79.88 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 121.022 0.439 . . . . 4.49 109.88 -174.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -49.0 -59.69 3.4 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 123.967 0.907 . . . . 1.05 112.098 168.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 555' ' ' LEU . . . . . . . . . . . . . 4.7 tp -54.33 -48.64 71.15 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 116.272 -0.422 . . . . 2.09 110.219 -179.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . 0.571 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 64.9 ttt180 -53.84 -35.93 62.01 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 113.739 1.015 . . . . 3.63 113.739 -178.228 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.06 -12.16 50.89 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.486 -0.486 . . . . 1.0 112.047 -177.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 558' ' ' HIS . . . . . 0.402 ' HE2' ' HZ1' ' B' ' 514' ' ' LYS . 94.2 m-70 -128.24 78.56 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 3.8 114.388 -177.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.57 -48.25 57.59 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.55 2.055 . . . . 3.87 116.55 -176.041 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 560' ' ' LYS . . . . . 0.414 ' HZ3' ' HA3' ' B' ' 605' ' ' GLY . 75.6 mmtt -56.68 -36.65 69.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 3.79 111.121 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 561' ' ' PHE . . . . . 0.41 ' O ' HG22 ' B' ' 565' ' ' VAL . 1.2 t80 -74.82 -45.09 45.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.142 -1.023 . . . . 1.8 112.009 175.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . 0.453 HD23 ' HE1' ' B' ' 599' ' ' PHE . 9.6 tt -50.07 -59.04 4.29 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.597 -0.274 . . . . 1.94 110.306 175.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -50.26 -38.62 41.78 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.805 1.039 . . . . 3.16 113.805 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 26.1 p -71.76 -39.43 70.01 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.534 0.683 . . . . 1.88 110.38 -176.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 565' ' ' VAL . . . . . 0.43 ' O ' ' HG ' ' B' ' 569' ' ' LEU . 95.7 t -62.8 -41.37 92.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.577 -0.738 . . . . 1.81 112.511 173.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 566' ' ' VAL . . . . . 0.566 HG21 HD13 ' B' ' 591' ' ' ILE . 46.3 t -70.99 -50.87 39.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 120.621 -0.432 . . . . 2.0 110.795 -176.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -51.11 -37.43 45.93 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.075 -0.511 . . . . 2.53 111.987 170.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -72.67 -32.63 65.96 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.733 -0.469 . . . . 3.93 109.733 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 569' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' B' ' 565' ' ' VAL . 54.1 mt -67.51 -36.47 81.11 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 108.703 -0.851 . . . . 2.53 108.703 177.072 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 570' ' ' PHE . . . . . 0.454 ' HD1' HG23 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.39 -39.43 92.21 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.851 -0.425 . . . . 4.72 109.851 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -57.52 -53.64 55.89 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 119.97 -0.692 . . . . 2.47 110.52 176.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -62.36 -9.99 9.9 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 114.092 1.145 . . . . 1.87 114.092 -177.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 573' ' ' MET . . . . . 0.628 ' HB3' HD22 ' B' ' 625' ' ' LEU . 89.5 mtp -76.35 -5.37 46.84 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.614 0.721 . . . . 2.56 109.641 178.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 60.6 m80 -109.39 -0.59 18.92 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.78 -1.1 . . . . 4.11 111.465 173.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 575' ' ' GLU . . . . . 0.6 ' HB3' HG12 ' B' ' 580' ' ' VAL . 8.1 tp10 -68.46 130.18 42.11 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.193 -0.458 . . . . 1.57 110.162 177.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 72.4 p -87.84 -21.35 25.08 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 112.991 0.737 . . . . 2.01 112.991 -177.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -60.2 128.03 34.76 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.364 0.602 . . . . 3.71 112.596 -175.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -44.9 125.88 5.4 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.388 -0.824 . . . . 2.15 113.103 -171.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.19 -34.65 4.81 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 116.207 1.243 . . . . 0.0 116.207 174.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 580' ' ' VAL . . . . . 0.6 HG12 ' HB3' ' B' ' 575' ' ' GLU . 13.4 p -53.75 -46.34 62.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.154 0.798 . . . . 1.89 113.154 -175.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -59.67 -42.29 92.56 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.365 0.506 . . . . 2.46 112.365 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -60.56 -42.36 96.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 112.243 0.461 . . . . 2.23 112.243 172.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 583' ' ' MET . . . . . 0.506 ' HE2' ' HB2' ' B' ' 542' ' ' SER . 40.0 tpp -60.71 -49.45 77.47 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 121.126 -0.229 . . . . 3.01 110.432 175.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.83 -43.06 80.68 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.196 -0.456 . . . . 1.01 111.634 -177.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 52.2 t -74.32 -40.92 61.9 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 119.997 -0.681 . . . . 2.2 112.025 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -59.55 -46.41 88.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.415 . . . . 1.98 111.886 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 587' ' ' THR . . . . . 0.701 HG22 ' HB3' ' B' ' 545' ' ' MET . 81.4 p -62.16 -41.22 98.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.92 110.43 175.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 588' ' ' PHE . . . . . 0.532 ' HA ' HG12 ' B' ' 591' ' ' ILE . 88.7 t80 -61.5 -32.09 72.11 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.085 -0.507 . . . . 0.72 111.189 -177.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 589' ' ' ILE . . . . . . . . . . . . . 48.5 mm -79.99 -35.87 16.4 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.89 -1.924 . . . . 2.46 109.806 -175.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -57.56 -50.01 74.5 Favored 'General case' 0 C--O 1.221 -0.438 0 N-CA-C 107.756 -1.201 . . . . 3.09 107.756 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . 0.566 HD13 HG21 ' B' ' 566' ' ' VAL . 37.1 pt -63.74 -43.72 98.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.688 -0.687 . . . . 2.43 112.802 -177.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . 0.471 ' N ' HG13 ' B' ' 591' ' ' ILE . . . -63.96 -39.13 93.43 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.494 -0.482 . . . . 1.01 112.261 177.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -62.41 -70.02 0.22 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 119.096 -1.041 . . . . 2.88 109.807 174.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -56.12 -23.82 36.72 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 116.587 2.069 . . . . 2.67 116.587 -176.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 595' ' ' CYS . . . . . 0.406 ' SG ' ' O ' ' B' ' 591' ' ' ILE . 1.3 p -121.61 25.14 9.47 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 114.247 1.203 . . . . 1.97 114.247 -178.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 596' ' ' ARG . . . . . 0.428 ' HA ' ' HE ' ' B' ' 596' ' ' ARG . 0.0 OUTLIER -48.5 -38.6 20.57 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.824 1.787 . . . . 4.07 115.824 -172.404 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -69.48 -32.62 71.62 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.214 0.82 . . . . 4.32 113.214 -175.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 598' ' ' HIS . . . . . 0.571 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 57.5 m-70 -70.15 -3.9 18.93 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.619 -0.719 . . . . 2.88 112.05 -173.558 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 599' ' ' PHE . . . . . 0.453 ' HE1' HD23 ' B' ' 562' ' ' LEU . 6.1 m-85 -105.51 -16.96 14.57 Favored 'General case' 0 CA--C 1.516 -0.329 0 O-C-N 123.669 0.606 . . . . 3.7 110.268 -176.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 9.3 p -105.84 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.039 -0.982 . . . . 2.05 111.325 -175.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -101.95 139.53 37.46 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.547 -0.861 . . . . 2.81 111.601 176.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 5.7 p -60.91 122.76 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.489 0 N-CA-C 108.577 -0.898 . . . . 1.99 108.577 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -92.83 167.34 11.91 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 123.705 0.628 . . . . 3.39 110.051 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 17.3 m -71.93 128.96 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 N-CA-C 112.981 0.734 . . . . 1.91 112.981 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 605' ' ' GLY . . . . . 0.414 ' HA3' ' HZ3' ' B' ' 560' ' ' LYS . . . 92.38 6.51 64.4 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.082 -175.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -131.55 158.04 42.0 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.555 -0.858 . . . . 2.51 110.766 175.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 31.5 m -103.24 -22.56 4.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.093 -0.958 . . . . 2.03 112.507 -175.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 608' ' ' MET . . . . . 0.415 ' HG3' ' HD2' ' B' ' 609' ' ' PRO . 59.6 ttp -136.99 142.26 37.79 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.643 0.609 . . . . 3.15 112.643 -174.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 609' ' ' PRO . . . . . 0.415 ' HD2' ' HG3' ' B' ' 608' ' ' MET . 68.9 Cg_exo -52.09 130.92 37.03 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.928 1.085 . . . . 0.85 112.094 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -57.01 -31.86 65.54 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.792 0.293 . . . . 3.05 111.792 -174.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 611' ' ' ILE . . . . . . . . . . . . . 14.0 tt -50.06 -44.75 22.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.814 0.34 . . . . 2.38 110.592 178.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -49.92 -52.11 35.7 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.632 0.773 . . . . 2.15 112.854 177.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -59.84 -37.14 78.39 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.612 -0.435 . . . . 2.66 110.21 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 41.6 mm -64.49 -48.04 86.71 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 120.169 -0.612 . . . . 2.28 111.946 178.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.57 -31.13 71.88 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.012 0.745 . . . . 2.38 113.012 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -79.55 2.1 23.46 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.569 1.322 . . . . 2.62 114.569 -179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 36.5 p30 -142.42 15.59 2.02 Favored 'General case' 0 C--O 1.242 0.685 0 N-CA-C 113.143 0.794 . . . . 2.63 113.143 -174.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 618' ' ' ILE . . . . . 0.407 HG22 ' N ' ' B' ' 619' ' ' ASN . 10.7 tt -46.9 -46.99 8.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.47 110.222 -176.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 619' ' ' ASN . . . . . 0.407 ' N ' HG22 ' B' ' 618' ' ' ILE . 45.4 t-20 -63.23 -51.06 67.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.754 1.02 . . . . 2.98 113.754 -176.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 73.3 p -56.89 -31.88 65.31 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 119.455 -0.898 . . . . 1.94 110.782 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 621' ' ' ILE . . . . . 0.454 HG23 ' HD1' ' B' ' 570' ' ' PHE . 17.7 mt -79.33 -42.64 23.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.334 1.605 . . . . 2.57 115.334 -179.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 622' ' ' ILE . . . . . 0.646 HG22 HG13 ' B' ' 630' ' ' VAL . 14.3 mt -87.69 -6.22 10.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.055 1.502 . . . . 2.61 115.055 -177.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 44.1 t -20.0 -58.34 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 116.529 2.048 . . . . 2.06 116.529 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -99.21 -7.58 26.3 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.977 -1.465 . . . . 2.07 111.027 -163.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 625' ' ' LEU . . . . . 0.628 HD22 ' HB3' ' B' ' 573' ' ' MET . 3.6 mm? -71.97 146.86 47.47 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.443 -0.344 . . . . 2.24 111.689 -173.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 626' ' ' GLN . . . . . 0.561 ' HB3' ' HD2' ' B' ' 627' ' ' PRO . 47.5 mt-30 -76.68 162.0 72.13 Favored Pre-proline 0 CA--C 1.519 -0.241 0 N-CA-C 108.834 -0.802 . . . . 2.99 108.834 174.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 627' ' ' PRO . . . . . 0.561 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 5.4 Cg_endo -47.71 -43.67 28.12 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 N-CA-C 115.825 1.433 . . . . 0.86 115.825 -178.473 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -67.31 -43.07 82.56 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.563 -0.532 . . . . 3.24 109.563 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -63.26 -38.29 90.57 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.946 -0.57 . . . . 2.79 110.926 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 630' ' ' VAL . . . . . 0.646 HG13 HG22 ' B' ' 622' ' ' ILE . 38.6 t . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.316 -0.85 . . . . 1.93 110.695 176.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 504' ' ' ILE . . . . . 0.606 HG12 ' HB1' ' B' ' 507' ' ' ALA . 14.5 tt . . . . . 0 C--O 1.236 0.371 0 N-CA-C 113.098 0.777 . . . . 2.63 113.098 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 48.1 m -48.85 119.2 3.01 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.6 0.592 . . . . 1.82 112.6 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.85 1.45 67.75 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.946 -0.645 . . . . 0.0 114.408 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 507' ' ' ALA . . . . . 0.606 ' HB1' HG12 ' B' ' 504' ' ' ILE . . . -94.34 -7.59 41.31 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.646 0.723 . . . . 1.02 112.443 176.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 25.8 mmt -112.4 160.06 18.1 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 121.116 0.484 . . . . 2.72 112.283 174.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -69.76 134.26 48.38 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.085 -0.709 . . . . 3.51 109.085 174.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 510' ' ' GLU . . . . . 0.592 ' HB2' HH21 ' B' ' 553' ' ' ARG . 39.7 tt0 -41.68 -35.47 0.78 Allowed 'General case' 0 C--O 1.24 0.598 0 N-CA-C 113.394 0.887 . . . . 2.66 113.394 -173.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -73.73 -41.94 61.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.515 -0.766 . . . . 2.44 112.117 -176.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -64.79 -40.16 94.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.178 0.513 . . . . 2.08 110.878 171.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 513' ' ' GLU . . . . . 0.422 ' O ' HD11 ' B' ' 517' ' ' LEU . 45.0 tt0 -53.76 -48.62 69.56 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.344 -0.843 . . . . 1.92 111.091 177.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -54.9 -57.59 11.02 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 111.911 0.337 . . . . 3.15 111.911 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -56.6 -35.89 68.77 Favored 'General case' 0 CA--C 1.506 -0.733 0 O-C-N 124.209 0.943 . . . . 4.26 111.127 -177.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.419 ' O ' HG22 ' B' ' 520' ' ' VAL . 73.8 t80 -76.11 -45.58 33.11 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.065 -0.971 . . . . 2.37 110.515 -173.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 517' ' ' LEU . . . . . 0.426 HD21 ' CG ' ' B' ' 551' ' ' TYR . 8.7 mp -66.73 -32.25 73.42 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.755 -0.657 . . . . 2.46 112.642 177.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 518' ' ' VAL . . . . . . . . . . . . . 28.3 m -67.49 -35.1 72.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 118.535 -1.266 . . . . 2.02 109.07 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 20.7 p -72.99 -36.31 67.03 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.393 0.616 . . . . 1.82 112.408 178.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 520' ' ' VAL . . . . . 0.419 HG22 ' O ' ' B' ' 516' ' ' PHE . 54.5 t -71.23 -42.29 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 122.133 -0.354 . . . . 1.86 111.703 -174.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 521' ' ' ILE . . . . . 0.449 ' O ' HD13 ' B' ' 525' ' ' LEU . 2.3 pp -90.68 -25.83 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.442 1.645 . . . . 2.46 115.442 -175.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 6.1 tmmm? -60.75 -35.24 75.89 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.712 -0.847 . . . . 2.99 108.712 173.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -92.42 -21.53 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.979 1.474 . . . . 2.17 114.979 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 38.4 mt -70.58 -45.43 65.37 Favored 'General case' 0 C--O 1.218 -0.588 0 N-CA-C 109.313 -0.625 . . . . 2.08 109.313 168.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . 0.464 HD11 HD13 ' B' ' 544' ' ' ILE . 7.5 mp -52.19 -45.43 65.15 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.197 0.522 . . . . 2.48 110.978 169.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 526' ' ' GLY . . . . . 0.425 ' O ' ' HG2' ' B' ' 529' ' ' GLU . . . -66.51 -40.63 94.33 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 -178.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 47.0 mt -63.52 -36.07 82.57 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 2.2 111.47 175.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 528' ' ' CYS . . . . . 0.45 ' HB2' HG21 ' B' ' 540' ' ' ILE . 49.5 t -63.54 -47.7 80.55 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.08 -0.509 . . . . 1.05 110.662 -175.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 529' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' B' ' 526' ' ' GLY . 13.0 pt-20 -61.8 -29.58 70.25 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.44 -0.8 . . . . 2.5 112.542 173.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -71.68 -54.64 9.67 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.376 0.88 . . . . 2.83 113.376 -177.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 531' ' ' LYS . . . . . 0.438 ' O ' ' HD2' ' B' ' 537' ' ' LYS . 67.6 mttm -68.8 137.95 54.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.964 -0.562 . . . . 2.73 111.119 -177.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -96.46 160.7 14.27 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.811 -0.631 . . . . 4.81 110.231 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.5 119.57 1.36 Allowed Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 115.905 -0.589 . . . . 0.0 114.019 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 534' ' ' LYS . . . . . 0.456 ' HD3' ' N ' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.11 -36.65 8.61 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.176 0.806 . . . . 3.36 113.176 177.274 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -50.51 -51.92 43.22 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.382 -0.527 . . . . 2.2 110.828 174.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -65.98 -44.85 83.66 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.697 0.628 . . . . 2.09 112.697 178.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 537' ' ' LYS . . . . . 0.438 ' HD2' ' O ' ' B' ' 531' ' ' LYS . 0.0 OUTLIER -67.78 -31.97 72.23 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.375 -0.53 . . . . 2.93 110.368 -174.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.2 -46.95 69.21 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.79 -0.641 . . . . 1.02 111.079 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 85.9 mt -58.1 -54.98 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.558 0.694 . . . . 2.34 111.295 173.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 540' ' ' ILE . . . . . 0.45 HG21 ' HB2' ' B' ' 528' ' ' CYS . 1.7 mp -56.82 -48.04 81.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.719 -0.613 . . . . 2.37 110.632 -178.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 541' ' ' ALA . . . . . 0.484 ' O ' ' HG2' ' B' ' 545' ' ' MET . . . -57.44 -44.21 84.55 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 113.514 0.931 . . . . 0.69 113.514 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 542' ' ' SER . . . . . 0.525 ' HB2' ' HE2' ' B' ' 583' ' ' MET . 90.7 p -60.36 -38.78 84.94 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.601 -0.44 . . . . 1.63 110.271 -178.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 543' ' ' ASN . . . . . 0.423 ' O ' HG12 ' B' ' 547' ' ' ILE . 3.1 t-20 -69.06 -47.06 66.28 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 114.362 1.245 . . . . 2.41 114.362 -175.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 544' ' ' ILE . . . . . 0.464 HD13 HD11 ' B' ' 525' ' ' LEU . 23.1 mt -52.66 -45.89 48.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.539 -0.912 . . . . 2.23 108.539 170.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 545' ' ' MET . . . . . 0.692 ' HB3' HG22 ' B' ' 587' ' ' THR . 33.4 mmt -64.05 -42.33 97.07 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 119.659 -0.816 . . . . 3.06 112.833 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -58.28 -48.77 79.41 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 119.189 -1.004 . . . . 2.36 109.893 176.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 547' ' ' ILE . . . . . 0.423 HG12 ' O ' ' B' ' 543' ' ' ASN . 43.3 mm -55.06 -61.48 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.77 0.656 . . . . 2.07 112.77 179.184 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 548' ' ' VAL . . . . . 0.68 HG13 HG22 ' B' ' 565' ' ' VAL . 97.9 t -47.3 -44.27 8.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 119.817 -0.753 . . . . 2.03 111.427 176.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.02 58.81 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.791 -0.568 . . . . 0.0 112.934 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -87.05 -9.55 55.21 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.629 0.604 . . . . 2.85 112.629 -175.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 551' ' ' TYR . . . . . 0.426 ' CG ' HD21 ' B' ' 517' ' ' LEU . 84.7 m-85 -120.45 59.69 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.798 1.036 . . . . 3.84 113.798 -176.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -55.97 -39.36 91.65 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 O-C-N 122.183 0.57 . . . . 0.89 113.162 177.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 553' ' ' ARG . . . . . 0.592 HH21 ' HB2' ' B' ' 510' ' ' GLU . 11.2 ptm180 -56.33 -46.72 79.77 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 121.147 0.499 . . . . 4.49 109.935 -174.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -48.96 -59.72 3.37 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.927 0.891 . . . . 1.05 112.12 167.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 555' ' ' LEU . . . . . 0.64 HD13 HG11 ' B' ' 548' ' ' VAL . 11.1 mp -54.39 -48.49 71.49 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 116.305 -0.407 . . . . 2.09 110.177 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -53.94 -35.88 62.19 Favored 'General case' 0 C--O 1.242 0.682 0 N-CA-C 113.791 1.034 . . . . 3.63 113.791 -178.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.1 -12.16 50.78 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.458 -0.497 . . . . 1.0 112.047 -177.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 17.4 t-160 -128.26 78.51 1.84 Allowed 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.456 1.28 . . . . 3.8 114.456 -177.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -50.48 -48.26 56.76 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 116.584 2.068 . . . . 3.87 116.584 -176.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -56.71 -36.65 69.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.325 -0.398 . . . . 3.79 111.099 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 561' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -74.84 -45.14 45.21 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.095 -1.042 . . . . 1.8 111.916 175.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . 0.529 ' O ' HG12 ' B' ' 565' ' ' VAL . 6.3 tt -49.99 -59.15 4.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.529 0.332 . . . . 1.94 110.226 175.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -50.21 -38.54 40.71 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.912 1.079 . . . . 3.16 113.912 178.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 24.0 p -71.92 -39.31 69.56 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.498 0.666 . . . . 1.88 110.371 -176.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 565' ' ' VAL . . . . . 0.68 HG22 HG13 ' B' ' 548' ' ' VAL . 0.3 OUTLIER -62.83 -41.24 91.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.676 -0.693 . . . . 1.81 112.543 173.361 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 566' ' ' VAL . . . . . . . . . . . . . 85.2 t -71.11 -50.83 39.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 C-N-CA 120.519 -0.473 . . . . 2.0 110.845 -176.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 15.1 m-80 -51.09 -37.42 45.63 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.965 -0.562 . . . . 2.53 112.01 170.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 36.1 mmtm -72.58 -32.76 66.26 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.701 -0.481 . . . . 3.93 109.701 -179.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 569' ' ' LEU . . . . . . . . . . . . . 4.3 mp -67.45 -36.51 81.34 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 108.737 -0.838 . . . . 2.53 108.737 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 570' ' ' PHE . . . . . 0.562 ' HA ' HD13 ' B' ' 621' ' ' ILE . 18.2 m-30 -65.29 -39.35 92.41 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.915 -0.402 . . . . 4.72 109.915 178.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.448 ' O ' ' ND1' ' B' ' 574' ' ' HIS . 36.8 tt0 -57.74 -53.44 58.16 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 119.921 -0.711 . . . . 2.47 110.508 176.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -62.43 -10.0 10.15 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.11 1.152 . . . . 1.87 114.11 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 573' ' ' MET . . . . . 0.492 ' HB3' HD22 ' B' ' 625' ' ' LEU . 54.9 mtt -76.4 -5.31 46.73 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.703 0.763 . . . . 2.56 109.646 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 574' ' ' HIS . . . . . 0.448 ' ND1' ' O ' ' B' ' 571' ' ' GLU . 0.0 OUTLIER -109.48 -0.51 18.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.729 -1.123 . . . . 4.11 111.434 173.792 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 575' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -68.51 130.18 42.11 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 116.217 -0.447 . . . . 1.57 110.094 177.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 3.9 t -87.79 -21.31 25.18 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.984 0.735 . . . . 2.01 112.984 -177.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 30.2 m80 -60.11 128.03 34.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.385 0.612 . . . . 3.71 112.597 -175.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -44.92 125.84 5.39 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.372 -0.831 . . . . 2.15 113.132 -171.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.3 -34.74 4.77 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.203 1.241 . . . . 0.0 116.203 174.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 47.5 t -53.67 -46.36 61.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.195 0.813 . . . . 1.89 113.195 -175.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 22.2 pt20 -59.72 -42.22 92.6 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.406 0.521 . . . . 2.46 112.406 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.54 -42.43 96.52 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.155 0.428 . . . . 2.23 112.155 172.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 583' ' ' MET . . . . . 0.525 ' HE2' ' HB2' ' B' ' 542' ' ' SER . 90.8 mmm -60.72 -49.46 77.41 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.069 -0.252 . . . . 3.01 110.43 175.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.78 -43.0 80.41 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.154 -0.475 . . . . 1.01 111.664 -177.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 585' ' ' CYS . . . . . 0.418 ' O ' HG12 ' B' ' 589' ' ' ILE . 52.7 t -74.38 -40.99 61.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 120.042 -0.663 . . . . 2.2 111.912 -177.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -59.58 -46.34 89.21 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.316 -0.402 . . . . 1.98 111.95 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 587' ' ' THR . . . . . 0.692 HG22 ' HB3' ' B' ' 545' ' ' MET . 36.4 p -62.15 -41.26 98.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.92 110.366 175.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -61.41 -32.25 72.19 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.147 -0.478 . . . . 0.72 111.129 -177.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 589' ' ' ILE . . . . . 0.418 HG12 ' O ' ' B' ' 585' ' ' CYS . 50.3 mm -79.88 -36.02 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 C-N-CA 116.902 -1.919 . . . . 2.46 109.775 -175.339 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -57.4 -50.01 74.35 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 107.75 -1.204 . . . . 3.09 107.75 176.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 83.9 mt -63.84 -43.76 97.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.697 -0.683 . . . . 2.43 112.726 -176.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.96 -39.1 93.37 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.425 -0.51 . . . . 1.01 112.285 177.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -62.38 -70.04 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 119.096 -1.041 . . . . 2.88 109.815 174.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -56.16 -23.72 36.66 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 116.596 2.073 . . . . 2.67 116.596 -176.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 82.8 m -121.71 25.14 9.42 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 114.241 1.2 . . . . 1.97 114.241 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -48.52 -38.47 20.4 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.835 1.791 . . . . 4.07 115.835 -172.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -69.7 -32.54 71.19 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.212 0.819 . . . . 4.32 113.212 -175.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 55.3 m80 -70.16 -3.77 18.36 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.593 -0.731 . . . . 2.88 112.08 -173.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -105.53 -17.01 14.55 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.564 0.54 . . . . 3.7 110.241 -176.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 21.6 t -105.82 -24.37 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.025 -0.989 . . . . 2.05 111.327 -175.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -101.97 139.49 37.53 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 119.566 -0.854 . . . . 2.81 111.576 176.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 11.8 m -60.85 122.69 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.671 -0.863 . . . . 1.99 108.671 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -92.75 167.3 11.97 Favored 'General case' 0 C--O 1.225 -0.213 0 O-C-N 123.659 0.599 . . . . 3.39 110.111 -177.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 34.9 t -71.94 128.96 35.47 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 N-CA-C 112.949 0.722 . . . . 1.91 112.949 -175.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.33 6.59 64.42 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.11 -175.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -131.53 157.99 42.12 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.565 -0.854 . . . . 2.51 110.745 175.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 29.2 t -103.2 -22.62 4.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.029 -0.987 . . . . 2.03 112.496 -175.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 608' ' ' MET . . . . . . . . . . . . . 66.0 mtm -136.91 142.25 37.87 Favored Pre-proline 0 C--O 1.223 -0.302 0 N-CA-C 112.626 0.602 . . . . 3.15 112.626 -174.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 609' ' ' PRO . . . . . 0.53 ' HB2' HG21 ' B' ' 611' ' ' ILE . 9.6 Cg_endo -52.08 130.88 36.85 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.845 1.03 . . . . 0.85 112.131 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -57.02 -31.79 65.49 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.826 0.306 . . . . 3.05 111.826 -174.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 611' ' ' ILE . . . . . 0.53 HG21 ' HB2' ' B' ' 609' ' ' PRO . 5.9 tp -50.1 -44.74 22.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 120.782 0.325 . . . . 2.38 110.577 178.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -49.9 -52.12 35.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.632 0.773 . . . . 2.15 112.855 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 613' ' ' GLU . . . . . 0.544 ' HA ' ' ND2' ' B' ' 616' ' ' ASN . 45.7 mt-10 -59.86 -37.03 78.16 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 120.512 -0.475 . . . . 2.66 110.231 179.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 62.1 mt -64.58 -48.03 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 120.149 -0.62 . . . . 2.28 111.907 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.63 -31.13 71.93 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.959 0.725 . . . . 2.38 112.959 -177.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 616' ' ' ASN . . . . . 0.544 ' ND2' ' HA ' ' B' ' 613' ' ' GLU . 20.6 p30 -79.57 2.15 23.33 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.559 1.318 . . . . 2.62 114.559 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -142.43 15.67 2.02 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 113.114 0.783 . . . . 2.63 113.114 -174.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 618' ' ' ILE . . . . . 0.529 ' O ' HG23 ' B' ' 621' ' ' ILE . 5.0 tp -46.95 -47.01 8.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 C-N-CA 118.973 -1.091 . . . . 2.47 110.135 -176.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 619' ' ' ASN . . . . . 0.4 ' N ' HG21 ' B' ' 618' ' ' ILE . 41.5 t-20 -63.23 -51.07 67.72 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 113.749 1.018 . . . . 2.98 113.749 -176.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 72.6 p -56.9 -31.93 65.39 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.455 -0.898 . . . . 1.94 110.737 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 621' ' ' ILE . . . . . 0.562 HD13 ' HA ' ' B' ' 570' ' ' PHE . 0.4 OUTLIER -79.32 -42.54 23.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 115.362 1.615 . . . . 2.57 115.362 -178.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 622' ' ' ILE . . . . . 0.4 HG12 ' O ' ' B' ' 618' ' ' ILE . 37.6 pt -87.73 -6.27 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.037 1.495 . . . . 2.61 115.037 -177.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 54.0 t -19.9 -58.33 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 116.642 2.09 . . . . 2.06 116.642 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -99.29 -7.56 26.18 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.028 -1.442 . . . . 2.07 110.989 -163.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 625' ' ' LEU . . . . . 0.492 HD22 ' HB3' ' B' ' 573' ' ' MET . 93.7 mt -71.94 146.93 47.46 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.295 0.372 . . . . 2.24 111.694 -173.623 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 626' ' ' GLN . . . . . 0.465 ' O ' HG12 ' B' ' 630' ' ' VAL . 17.3 mp0 -76.74 162.1 71.65 Favored Pre-proline 0 N--CA 1.463 0.189 0 N-CA-C 108.776 -0.824 . . . . 2.99 108.776 174.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 627' ' ' PRO . . . . . 0.522 ' O ' HG22 ' B' ' 630' ' ' VAL . 79.4 Cg_exo -47.81 -43.56 28.89 Favored 'Trans proline' 0 CA--C 1.529 0.243 0 N-CA-C 115.856 1.445 . . . . 0.86 115.856 -178.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -67.36 -43.02 82.47 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.608 -0.516 . . . . 3.24 109.608 -174.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -63.28 -38.33 90.72 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.929 -0.578 . . . . 2.79 110.831 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 630' ' ' VAL . . . . . 0.522 HG22 ' O ' ' B' ' 627' ' ' PRO . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.353 -0.832 . . . . 1.93 110.661 176.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 504' ' ' ILE . . . . . 0.664 HG13 ' HB2' ' B' ' 507' ' ' ALA . 7.6 tp . . . . . 0 C--O 1.235 0.309 0 N-CA-C 113.076 0.769 . . . . 2.63 113.076 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 80.0 p -48.91 119.12 2.97 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.53 0.567 . . . . 1.82 112.53 174.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.9 1.39 67.67 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 120.964 -0.636 . . . . 0.0 114.37 -179.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 507' ' ' ALA . . . . . 0.664 ' HB2' HG13 ' B' ' 504' ' ' ILE . . . -94.29 -7.56 41.57 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 117.736 0.768 . . . . 1.02 112.405 176.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -112.49 160.02 18.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.191 0.519 . . . . 2.72 112.186 174.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -69.78 134.14 48.23 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.131 -0.692 . . . . 3.51 109.131 174.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -41.57 -35.46 0.73 Allowed 'General case' 0 C--O 1.24 0.567 0 N-CA-C 113.421 0.897 . . . . 2.66 113.421 -173.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.78 -41.96 61.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.505 -0.771 . . . . 2.44 112.082 -176.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.87 -40.04 94.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.133 0.492 . . . . 2.08 110.893 171.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -53.66 -48.76 69.12 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.387 -0.824 . . . . 1.92 111.102 177.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 514' ' ' LYS . . . . . 0.636 ' HB3' ' HZ2' ' B' ' 514' ' ' LYS . 7.3 mtpm? -54.77 -57.67 10.62 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 111.869 0.322 . . . . 3.15 111.869 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -56.59 -35.96 68.82 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.173 0.921 . . . . 4.26 111.086 -177.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.467 ' O ' HG21 ' B' ' 520' ' ' VAL . 62.5 t80 -76.09 -45.6 33.16 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.159 -0.928 . . . . 2.37 110.514 -173.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 517' ' ' LEU . . . . . . . . . . . . . 13.7 tp -66.74 -32.25 73.43 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.731 -0.668 . . . . 2.46 112.615 177.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 518' ' ' VAL . . . . . 0.494 ' O ' ' HB2' ' B' ' 522' ' ' LYS . 69.3 t -67.5 -35.13 72.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 118.58 -1.248 . . . . 2.02 109.081 178.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 74.1 p -72.94 -36.37 67.19 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.82 112.413 178.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 520' ' ' VAL . . . . . 0.467 HG21 ' O ' ' B' ' 516' ' ' PHE . 67.0 t -71.14 -42.45 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 116.46 -0.336 . . . . 1.86 111.638 -174.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 521' ' ' ILE . . . . . . . . . . . . . 17.6 tt -90.65 -25.78 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 115.406 1.632 . . . . 2.46 115.406 -175.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 522' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' B' ' 518' ' ' VAL . 0.3 OUTLIER -60.92 -35.25 76.2 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.599 -0.889 . . . . 2.99 108.599 173.6 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -92.4 -21.35 20.27 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.062 1.504 . . . . 2.17 115.062 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 68.5 mt -70.64 -45.38 65.26 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.3 -0.63 . . . . 2.08 109.3 168.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.31 -45.4 65.56 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.2 0.524 . . . . 2.48 110.931 169.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.55 -40.47 94.22 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 40.2 mt -63.63 -36.14 82.84 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.043 0.449 . . . . 2.2 111.426 175.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 48.1 t -63.47 -47.74 80.54 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.041 -0.527 . . . . 1.05 110.648 -175.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -61.8 -29.52 70.21 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.472 -0.786 . . . . 2.5 112.517 173.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -71.71 -54.65 9.61 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.353 0.872 . . . . 2.83 113.353 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -68.76 137.94 54.44 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.008 -0.542 . . . . 2.73 111.07 -177.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 532' ' ' ARG . . . . . 0.43 ' HA ' ' NZ ' ' B' ' 537' ' ' LYS . 35.8 mmt180 -96.44 160.67 14.28 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.774 -0.648 . . . . 4.81 110.183 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.44 119.67 1.36 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.984 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 534' ' ' LYS . . . . . 0.608 ' H ' ' HD2' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.18 -36.64 8.92 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.207 0.817 . . . . 3.36 113.207 177.245 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -50.5 -51.85 43.66 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.413 -0.515 . . . . 2.2 110.828 174.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -66.09 -44.85 83.21 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.62 0.6 . . . . 2.09 112.62 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 537' ' ' LYS . . . . . 0.43 ' NZ ' ' HA ' ' B' ' 532' ' ' ARG . 64.6 mttp -67.87 -31.98 72.16 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.93 110.272 -174.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.09 -46.99 69.45 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.839 -0.619 . . . . 1.02 111.115 178.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 75.8 mt -58.12 -55.03 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 121.569 0.699 . . . . 2.34 111.194 173.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 540' ' ' ILE . . . . . . . . . . . . . 94.0 mt -56.81 -48.07 81.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 2.37 110.605 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 541' ' ' ALA . . . . . 0.431 ' O ' ' HG2' ' B' ' 545' ' ' MET . . . -57.49 -43.99 84.6 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 113.583 0.957 . . . . 0.69 113.583 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 94.8 p -60.46 -38.86 85.54 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.647 -0.421 . . . . 1.63 110.215 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 543' ' ' ASN . . . . . 0.446 ' O ' HG12 ' B' ' 547' ' ' ILE . 49.5 t30 -69.05 -47.05 66.35 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 114.352 1.241 . . . . 2.41 114.352 -175.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 544' ' ' ILE . . . . . 0.455 HG13 ' N ' ' B' ' 545' ' ' MET . 48.9 pt -52.63 -45.94 48.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.492 -0.929 . . . . 2.23 108.492 170.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 545' ' ' MET . . . . . 0.455 ' N ' HG13 ' B' ' 544' ' ' ILE . 21.4 mmt -64.03 -42.33 97.12 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.729 -0.788 . . . . 3.06 112.818 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -58.3 -48.78 79.41 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 119.181 -1.007 . . . . 2.36 109.887 176.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 547' ' ' ILE . . . . . 0.446 HG12 ' O ' ' B' ' 543' ' ' ASN . 42.0 mm -55.06 -61.38 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.823 0.675 . . . . 2.07 112.823 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 548' ' ' VAL . . . . . 0.404 HG22 ' HA ' ' B' ' 545' ' ' MET . 36.0 m -47.44 -44.23 9.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 C-N-CA 119.854 -0.738 . . . . 2.03 111.388 176.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.03 58.82 Favored Glycine 0 C--O 1.237 0.336 0 O-C-N 121.791 -0.568 . . . . 0.0 112.917 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 550' ' ' GLN . . . . . 0.576 HE21 ' HA ' ' B' ' 550' ' ' GLN . 0.1 OUTLIER -87.04 -9.58 55.14 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 112.629 0.604 . . . . 2.85 112.629 -175.356 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 551' ' ' TYR . . . . . 0.429 ' O ' HD12 ' B' ' 555' ' ' LEU . 64.4 m-85 -120.38 59.63 6.95 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 113.857 1.058 . . . . 3.84 113.857 -176.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 552' ' ' PRO . . . . . 0.551 ' HG3' ' HG2' ' B' ' 594' ' ' LYS . 15.4 Cg_endo -55.99 -39.35 91.72 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.122 0.538 . . . . 0.89 113.115 178.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 22.0 tpp180 -56.3 -46.81 79.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.134 0.492 . . . . 4.49 109.859 -174.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 554' ' ' PHE . . . . . 0.473 ' HD2' HD13 ' B' ' 555' ' ' LEU . 67.8 t80 -48.88 -59.81 3.27 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.935 0.894 . . . . 1.05 112.098 168.014 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 555' ' ' LEU . . . . . 0.473 HD13 ' HD2' ' B' ' 554' ' ' PHE . 8.2 mp -54.26 -48.62 70.96 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.303 -0.408 . . . . 2.09 110.219 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -53.83 -35.91 61.96 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.831 1.049 . . . . 3.63 113.831 -178.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.03 -12.25 50.76 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.517 -0.473 . . . . 1.0 112.088 -177.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 558' ' ' HIS . . . . . 0.432 ' HE2' ' HE2' ' B' ' 514' ' ' LYS . 32.3 m80 -128.18 78.5 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 3.8 114.388 -177.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 22.0 m-90 -50.52 -48.32 57.18 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 116.534 2.05 . . . . 3.87 116.534 -176.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 560' ' ' LYS . . . . . 0.512 ' HA ' ' HE3' ' B' ' 563' ' ' LYS . 37.8 mtmm -56.48 -36.66 69.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.324 -0.398 . . . . 3.79 111.213 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 561' ' ' PHE . . . . . 0.407 ' O ' HG22 ' B' ' 565' ' ' VAL . 0.7 OUTLIER -74.95 -45.07 44.81 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 119.142 -1.023 . . . . 1.8 111.871 175.613 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . 0.421 ' O ' HG21 ' B' ' 566' ' ' VAL . 3.9 tp -50.01 -59.15 4.17 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.509 0.324 . . . . 1.94 110.258 175.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 563' ' ' LYS . . . . . 0.512 ' HE3' ' HA ' ' B' ' 560' ' ' LYS . 19.6 pttp -50.18 -38.66 40.81 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.896 1.073 . . . . 3.16 113.896 178.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 62.4 m -71.74 -39.39 70.1 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.562 0.696 . . . . 1.88 110.413 -176.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 565' ' ' VAL . . . . . 0.407 HG22 ' O ' ' B' ' 561' ' ' PHE . 92.2 t -62.84 -41.34 92.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.646 -0.706 . . . . 1.81 112.527 173.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 566' ' ' VAL . . . . . 0.421 HG21 ' O ' ' B' ' 562' ' ' LEU . 36.2 t -70.93 -50.85 40.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 120.551 -0.46 . . . . 2.0 110.924 -176.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -51.11 -37.38 45.67 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.03 -0.532 . . . . 2.53 111.987 170.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 568' ' ' LYS . . . . . 0.555 ' HZ2' ' HB2' ' B' ' 568' ' ' LYS . 0.6 OUTLIER -72.72 -32.68 65.89 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.599 -0.519 . . . . 3.93 109.599 -179.117 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 569' ' ' LEU . . . . . 0.431 HD23 ' HB2' ' B' ' 588' ' ' PHE . 3.4 mp -67.53 -36.42 80.97 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 108.712 -0.847 . . . . 2.53 108.712 177.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -65.34 -39.39 92.33 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.899 -0.408 . . . . 4.72 109.899 178.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -57.67 -53.46 57.94 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 120.036 -0.665 . . . . 2.47 110.521 176.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -62.57 -9.91 10.36 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.018 1.118 . . . . 1.87 114.018 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 573' ' ' MET . . . . . 0.408 ' HG3' ' O ' ' B' ' 569' ' ' LEU . 65.6 mtt -76.36 -5.29 46.56 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.671 0.748 . . . . 2.56 109.7 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -109.43 -0.54 18.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.73 -1.123 . . . . 4.11 111.465 173.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 575' ' ' GLU . . . . . 0.574 ' HB3' HG13 ' B' ' 580' ' ' VAL . 7.2 tp10 -68.59 130.28 42.38 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.189 -0.46 . . . . 1.57 110.104 177.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 62.2 p -87.92 -21.27 25.03 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 113.006 0.743 . . . . 2.01 113.006 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 577' ' ' HIS . . . . . 0.442 ' O ' HG11 ' B' ' 580' ' ' VAL . 10.7 t60 -60.2 128.02 34.72 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.418 0.628 . . . . 3.71 112.545 -175.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -44.83 125.87 5.32 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.38 -0.827 . . . . 2.15 113.135 -171.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.23 -34.74 4.75 Favored Glycine 0 C--O 1.223 -0.57 0 N-CA-C 116.254 1.262 . . . . 0.0 116.254 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 580' ' ' VAL . . . . . 0.574 HG13 ' HB3' ' B' ' 575' ' ' GLU . 13.6 p -53.82 -46.34 63.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 113.121 0.785 . . . . 1.89 113.121 -175.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.435 ' HG2' ' N ' ' B' ' 582' ' ' ASP . 0.7 OUTLIER -59.67 -42.21 92.37 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.406 0.521 . . . . 2.46 112.406 -179.852 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 582' ' ' ASP . . . . . 0.481 ' HA ' ' OE1' ' B' ' 629' ' ' GLN . 19.3 t70 -60.54 -42.5 96.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.149 0.425 . . . . 2.23 112.149 172.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 583' ' ' MET . . . . . 0.492 ' HE3' ' HA ' ' B' ' 583' ' ' MET . 31.8 mmt -60.66 -49.49 77.29 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 121.109 -0.236 . . . . 3.01 110.439 175.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.87 -42.87 80.54 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.176 -0.465 . . . . 1.01 111.74 -177.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 44.4 t -74.43 -40.92 61.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 120.009 -0.676 . . . . 2.2 111.957 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.58 -46.31 89.3 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.306 -0.406 . . . . 1.98 111.95 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 587' ' ' THR . . . . . 0.439 ' HG1' ' HB3' ' B' ' 545' ' ' MET . 41.0 m -62.15 -41.25 98.11 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.329 0.652 . . . . 1.92 110.413 175.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 588' ' ' PHE . . . . . 0.431 ' HB2' HD23 ' B' ' 569' ' ' LEU . 87.0 t80 -61.52 -32.15 72.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.007 -0.542 . . . . 0.72 111.125 -177.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 589' ' ' ILE . . . . . . . . . . . . . 47.4 mm -79.86 -36.0 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.871 -1.932 . . . . 2.46 109.8 -175.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -57.44 -50.01 74.39 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 107.713 -1.218 . . . . 3.09 107.713 176.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 98.2 mt -63.82 -43.82 98.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 112.786 0.661 . . . . 2.43 112.786 -177.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.83 -39.14 93.52 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.291 0.478 . . . . 1.01 112.291 177.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -62.32 -70.14 0.22 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.155 -1.018 . . . . 2.88 109.772 174.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 594' ' ' LYS . . . . . 0.551 ' HG2' ' HG3' ' B' ' 552' ' ' PRO . 2.3 mppt? -56.11 -23.84 36.81 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.562 2.06 . . . . 2.67 116.562 -176.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 83.6 m -121.67 25.22 9.4 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.263 1.209 . . . . 1.97 114.263 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 596' ' ' ARG . . . . . 0.527 ' HA ' ' CE2' ' B' ' 599' ' ' PHE . 34.4 ptt180 -48.52 -38.54 20.57 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.83 1.789 . . . . 4.07 115.83 -172.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 68.7 mtm180 -69.52 -32.61 71.56 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.214 0.82 . . . . 4.32 113.214 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -3.81 18.68 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.577 -0.738 . . . . 2.88 112.052 -173.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 599' ' ' PHE . . . . . 0.527 ' CE2' ' HA ' ' B' ' 596' ' ' ARG . 0.1 OUTLIER -105.62 -16.89 14.57 Favored 'General case' 0 CA--C 1.517 -0.32 0 O-C-N 123.621 0.576 . . . . 3.7 110.158 -176.552 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 600' ' ' VAL . . . . . 0.455 ' N ' ' HD1' ' B' ' 599' ' ' PHE . 9.4 p -105.82 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.162 -0.926 . . . . 2.05 111.327 -175.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -102.04 139.52 37.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 119.551 -0.86 . . . . 2.81 111.596 176.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 3.9 p -60.89 122.74 12.14 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 108.597 -0.89 . . . . 1.99 108.597 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -92.76 167.3 11.97 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 123.675 0.609 . . . . 3.39 110.086 -177.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 7.4 p -71.94 129.01 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 N-CA-C 112.927 0.714 . . . . 1.91 112.927 -175.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.31 6.53 64.51 Favored Glycine 0 N--CA 1.446 -0.7 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.111 -175.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 606' ' ' GLU . . . . . 0.487 ' HG3' ' H ' ' B' ' 608' ' ' MET . 8.3 tp10 -131.5 158.0 42.04 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.557 -0.857 . . . . 2.51 110.746 175.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 16.7 t -103.27 -22.55 4.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.032 -0.985 . . . . 2.03 112.451 -175.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 608' ' ' MET . . . . . 0.487 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 88.2 mtp -136.95 142.28 37.94 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.672 0.619 . . . . 3.15 112.672 -174.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -52.08 130.88 36.86 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.85 112.131 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -57.02 -31.76 65.46 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.826 0.306 . . . . 3.05 111.826 -174.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 611' ' ' ILE . . . . . 0.514 HG12 ' O ' ' B' ' 599' ' ' PHE . 6.4 pt -50.05 -44.87 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 120.784 0.326 . . . . 2.38 110.513 178.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 612' ' ' ASP . . . . . 0.438 ' H ' HG13 ' B' ' 611' ' ' ILE . 24.8 m-20 -49.94 -52.01 36.69 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.621 0.769 . . . . 2.15 112.844 177.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -59.94 -37.14 78.65 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.613 -0.435 . . . . 2.66 110.175 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 65.2 mt -64.51 -48.02 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.214 -0.594 . . . . 2.28 111.961 178.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 615' ' ' LEU . . . . . 0.544 HD11 HD12 ' B' ' 618' ' ' ILE . 4.5 mm? -62.63 -31.11 71.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.958 0.725 . . . . 2.38 112.958 -177.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -79.54 2.14 23.3 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.662 1.356 . . . . 2.62 114.662 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -142.42 15.61 2.02 Favored 'General case' 0 C--O 1.243 0.72 0 N-CA-C 113.152 0.797 . . . . 2.63 113.152 -174.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 618' ' ' ILE . . . . . 0.544 HD12 HD11 ' B' ' 615' ' ' LEU . 72.0 mt -46.83 -47.14 8.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 118.997 -1.081 . . . . 2.47 110.176 -176.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 619' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -63.09 -51.14 67.79 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.744 1.016 . . . . 2.98 113.744 -176.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 32.6 m -56.92 -31.87 65.38 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 119.487 -0.885 . . . . 1.94 110.743 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 621' ' ' ILE . . . . . . . . . . . . . 64.6 mt -79.32 -42.7 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 115.334 1.605 . . . . 2.57 115.334 -178.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 622' ' ' ILE . . . . . . . . . . . . . 47.2 pt -87.5 -6.48 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 115.059 1.503 . . . . 2.61 115.059 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 8.7 p -19.91 -58.3 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.575 2.065 . . . . 2.06 116.575 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -99.26 -7.57 26.23 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 114.045 -1.434 . . . . 2.07 111.043 -163.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 625' ' ' LEU . . . . . . . . . . . . . 96.0 mt -71.93 146.9 47.51 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 123.286 0.366 . . . . 2.24 111.601 -173.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 626' ' ' GLN . . . . . 0.409 ' O ' HG23 ' B' ' 630' ' ' VAL . 1.7 mp0 -76.74 162.09 71.7 Favored Pre-proline 0 CA--C 1.52 -0.191 0 N-CA-C 108.835 -0.802 . . . . 2.99 108.835 174.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -47.85 -43.58 29.09 Favored 'Trans proline' 0 C--O 1.233 0.256 0 N-CA-C 115.765 1.409 . . . . 0.86 115.765 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 628' ' ' GLN . . . . . 0.566 ' HG3' HE21 ' B' ' 629' ' ' GLN . 20.9 pt20 -67.33 -42.98 82.67 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.637 -0.505 . . . . 3.24 109.637 -174.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 629' ' ' GLN . . . . . 0.566 HE21 ' HG3' ' B' ' 628' ' ' GLN . 29.1 mm-40 -63.31 -38.23 90.35 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.924 -0.58 . . . . 2.79 110.924 178.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 630' ' ' VAL . . . . . 0.409 HG23 ' O ' ' B' ' 626' ' ' GLN . 95.1 t . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.315 -0.85 . . . . 1.93 110.685 176.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 44.7 pt . . . . . 0 C--O 1.237 0.419 0 N-CA-C 113.015 0.746 . . . . 2.63 113.015 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 78.4 p -48.83 119.11 2.94 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.519 0.563 . . . . 1.82 112.519 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.76 1.53 67.92 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 120.961 -0.638 . . . . 0.0 114.436 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.39 -7.52 41.35 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 117.685 0.742 . . . . 1.02 112.434 176.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 67.5 mtt -112.45 159.97 18.22 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.116 0.484 . . . . 2.72 112.263 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 72.8 m80 -69.73 134.28 48.45 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.042 -0.725 . . . . 3.51 109.042 174.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -41.73 -35.32 0.76 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.409 0.892 . . . . 2.66 113.409 -173.255 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -73.88 -41.88 61.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.598 -0.728 . . . . 2.44 112.097 -176.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -64.85 -40.18 94.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.184 0.516 . . . . 2.08 110.823 171.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -53.61 -48.67 69.07 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.347 -0.842 . . . . 1.92 111.199 177.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -54.91 -57.53 11.24 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 111.912 0.338 . . . . 3.15 111.912 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -56.71 -35.92 69.07 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 124.16 0.913 . . . . 4.26 111.037 -177.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.442 ' O ' HG22 ' B' ' 520' ' ' VAL . 86.1 t80 -76.12 -45.52 33.33 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.191 -0.913 . . . . 2.37 110.539 -173.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 517' ' ' LEU . . . . . 0.43 ' O ' HG23 ' B' ' 521' ' ' ILE . 0.2 OUTLIER -66.8 -32.2 73.33 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.738 -0.665 . . . . 2.46 112.658 177.104 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 518' ' ' VAL . . . . . . . . . . . . . 3.2 p -67.49 -35.14 72.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 118.483 -1.287 . . . . 2.02 109.031 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 76.3 p -73.02 -36.3 66.94 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.348 0.594 . . . . 1.82 112.401 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 520' ' ' VAL . . . . . 0.442 HG22 ' O ' ' B' ' 516' ' ' PHE . 55.5 t -71.25 -42.24 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 122.162 -0.336 . . . . 1.86 111.702 -174.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 521' ' ' ILE . . . . . 0.43 HG23 ' O ' ' B' ' 517' ' ' LEU . 13.5 tt -90.73 -25.83 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 115.42 1.637 . . . . 2.46 115.42 -175.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -60.77 -35.19 75.81 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.712 -0.847 . . . . 2.99 108.712 173.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -92.5 -21.44 20.14 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 115.001 1.482 . . . . 2.17 115.001 -177.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 70.1 mt -70.69 -45.27 65.33 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.314 -0.624 . . . . 2.08 109.314 168.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 70.1 mt -52.32 -45.42 65.59 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.315 0.579 . . . . 2.48 110.962 169.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.47 -40.53 94.38 Favored Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.63 -36.14 82.83 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.036 0.446 . . . . 2.2 111.426 175.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 40.2 t -63.54 -47.68 80.61 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.023 -0.535 . . . . 1.05 110.699 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.67 -29.6 70.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.485 -0.78 . . . . 2.5 112.566 173.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -71.78 -54.68 9.42 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.283 0.846 . . . . 2.83 113.283 -177.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 531' ' ' LYS . . . . . 0.546 ' HD2' HD11 ' B' ' 540' ' ' ILE . 80.0 mttt -68.73 137.89 54.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.065 -0.516 . . . . 2.73 111.047 -177.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -96.42 160.63 14.31 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.837 -0.619 . . . . 4.81 110.158 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.47 119.58 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.848 -0.614 . . . . 0.0 114.022 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -47.02 -36.66 8.14 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.259 0.837 . . . . 3.36 113.259 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 535' ' ' ASP . . . . . 0.55 ' HA ' ' HE2' ' B' ' 577' ' ' HIS . 6.3 p-10 -50.56 -51.85 44.32 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.373 -0.531 . . . . 2.2 110.809 174.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.06 -44.83 83.37 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.62 0.6 . . . . 2.09 112.62 178.314 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 537' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -67.87 -31.9 72.03 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.93 110.272 -174.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.21 -47.0 69.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.862 -0.608 . . . . 1.02 111.048 178.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 48.4 mm -58.12 -54.98 25.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 121.549 0.69 . . . . 2.34 111.234 173.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 540' ' ' ILE . . . . . 0.546 HD11 ' HD2' ' B' ' 531' ' ' LYS . 80.7 mt -56.75 -48.14 81.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 2.37 110.59 -178.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.46 -44.09 84.52 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 113.595 0.961 . . . . 0.69 113.595 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 62.3 m -60.42 -38.81 85.23 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 120.545 -0.462 . . . . 1.63 110.306 -178.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 40.5 t-20 -68.92 -47.12 66.54 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 114.365 1.246 . . . . 2.41 114.365 -175.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 544' ' ' ILE . . . . . . . . . . . . . 95.1 mt -52.6 -46.06 48.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.424 -0.954 . . . . 2.23 108.424 170.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 545' ' ' MET . . . . . 0.718 ' HB3' HG21 ' B' ' 587' ' ' THR . 45.3 mtp -63.97 -42.33 97.28 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.78 -0.768 . . . . 3.06 112.818 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -58.35 -48.71 79.7 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 119.145 -1.022 . . . . 2.36 109.932 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 80.8 mt -55.07 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.8 0.667 . . . . 2.07 112.8 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 548' ' ' VAL . . . . . 0.405 HG22 ' HA ' ' B' ' 545' ' ' MET . 33.8 m -47.42 -44.17 9.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.812 -0.755 . . . . 2.03 111.427 176.265 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 549' ' ' GLY . . . . . 0.53 ' HA2' HD13 ' B' ' 591' ' ' ILE . . . -57.41 -28.08 58.9 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -86.99 -9.57 55.26 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.614 0.598 . . . . 2.85 112.614 -175.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -120.43 59.74 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.781 1.03 . . . . 3.84 113.781 -176.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.03 -39.36 91.69 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 O-C-N 122.071 0.511 . . . . 0.89 113.134 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 9.9 mmm180 -56.23 -46.78 79.4 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 121.169 0.509 . . . . 4.49 109.974 -174.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -48.9 -59.84 3.25 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 123.89 0.876 . . . . 1.05 112.101 167.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 555' ' ' LEU . . . . . . . . . . . . . 11.2 mp -54.26 -48.56 71.05 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 116.267 -0.424 . . . . 2.09 110.202 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 556' ' ' ARG . . . . . 0.459 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 78.6 ttt180 -53.93 -35.87 62.16 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 113.827 1.047 . . . . 3.63 113.827 -178.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.06 -12.17 50.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.517 -0.473 . . . . 1.0 112.102 -177.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -128.23 78.5 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 3.8 114.388 -177.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 33.4 p90 -50.51 -48.28 57.06 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 116.57 2.063 . . . . 3.87 116.57 -176.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -56.57 -36.68 69.62 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.23 -0.441 . . . . 3.79 111.136 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 561' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -74.89 -45.08 45.24 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.092 -1.043 . . . . 1.8 111.978 175.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 2.9 tt -49.99 -59.13 4.18 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 122.403 0.281 . . . . 1.94 110.34 175.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 563' ' ' LYS . . . . . 0.472 ' HZ1' HD22 ' B' ' 567' ' ' ASN . 0.2 OUTLIER -50.14 -38.63 40.18 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.922 1.082 . . . . 3.16 113.922 178.802 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 20.1 p -71.89 -39.31 69.66 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.732 -0.667 . . . . 1.88 110.356 -176.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 565' ' ' VAL . . . . . . . . . . . . . 68.5 t -62.81 -41.31 92.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.685 -0.689 . . . . 1.81 112.542 173.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 566' ' ' VAL . . . . . 0.431 HG22 ' HZ ' ' B' ' 599' ' ' PHE . 58.1 t -71.0 -50.93 39.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.542 -0.463 . . . . 2.0 110.844 -176.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 567' ' ' ASN . . . . . 0.472 HD22 ' HZ1' ' B' ' 563' ' ' LYS . 91.1 m-20 -51.08 -37.37 45.32 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.996 -0.547 . . . . 2.53 112.012 170.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 29.2 ttpt -72.67 -32.6 65.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.753 -0.462 . . . . 3.93 109.753 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 569' ' ' LEU . . . . . 0.469 ' O ' ' HG3' ' B' ' 573' ' ' MET . 4.2 mp -67.46 -36.5 81.28 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.73 -0.841 . . . . 2.53 108.73 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 570' ' ' PHE . . . . . 0.519 ' HD1' HG13 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.38 -39.38 92.17 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.872 -0.418 . . . . 4.72 109.872 178.372 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -57.66 -53.45 58.06 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 119.999 -0.68 . . . . 2.47 110.545 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.56 -9.86 10.16 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.079 1.14 . . . . 1.87 114.079 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 573' ' ' MET . . . . . 0.649 ' HB3' HD13 ' B' ' 625' ' ' LEU . 64.0 mtt -76.42 -5.35 46.93 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.639 0.733 . . . . 2.56 109.662 178.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -109.4 -0.48 18.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.755 -1.112 . . . . 4.11 111.428 173.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 575' ' ' GLU . . . . . 0.423 ' HG2' HG12 ' B' ' 580' ' ' VAL . 14.4 tp10 -68.48 130.2 42.17 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.214 -0.448 . . . . 1.57 110.079 177.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 7.2 m -87.87 -21.24 25.1 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.042 0.756 . . . . 2.01 113.042 -177.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 577' ' ' HIS . . . . . 0.55 ' HE2' ' HA ' ' B' ' 535' ' ' ASP . 0.8 OUTLIER -60.22 128.03 34.75 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.411 0.624 . . . . 3.71 112.596 -175.4 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 578' ' ' ASP . . . . . 0.549 ' H ' ' HD1' ' B' ' 577' ' ' HIS . 7.1 m-20 -44.88 125.88 5.38 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.388 -0.824 . . . . 2.15 113.063 -171.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.26 -34.75 4.75 Favored Glycine 0 C--O 1.222 -0.627 0 N-CA-C 116.29 1.276 . . . . 0.0 116.29 174.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 580' ' ' VAL . . . . . 0.423 HG12 ' HG2' ' B' ' 575' ' ' GLU . 58.1 t -53.68 -46.42 61.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.146 0.795 . . . . 1.89 113.146 -175.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -59.6 -42.31 92.29 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.383 0.512 . . . . 2.46 112.383 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 582' ' ' ASP . . . . . 0.53 ' HA ' ' HG ' ' B' ' 585' ' ' CYS . 17.3 t70 -60.54 -42.42 96.46 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.213 0.449 . . . . 2.23 112.213 172.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 25.7 mmt -60.71 -49.48 77.32 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.058 -0.257 . . . . 3.01 110.447 175.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.86 -42.83 80.46 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.159 -0.473 . . . . 1.01 111.79 -177.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 585' ' ' CYS . . . . . 0.53 ' HG ' ' HA ' ' B' ' 582' ' ' ASP . 23.6 p -74.4 -40.92 61.73 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 119.957 -0.697 . . . . 2.2 111.984 -177.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 586' ' ' ASP . . . . . 0.462 ' O ' HG12 ' B' ' 589' ' ' ILE . 18.0 t70 -59.53 -46.38 89.04 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.273 -0.421 . . . . 1.98 111.92 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 587' ' ' THR . . . . . 0.718 HG21 ' HB3' ' B' ' 545' ' ' MET . 40.4 p -62.19 -41.18 98.1 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.92 110.43 175.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -61.55 -32.14 72.2 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.035 -0.53 . . . . 0.72 111.153 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 589' ' ' ILE . . . . . 0.462 HG12 ' O ' ' B' ' 586' ' ' ASP . 41.5 pt -79.94 -35.85 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.871 -1.932 . . . . 2.46 109.76 -175.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -57.52 -50.04 74.38 Favored 'General case' 0 C--O 1.221 -0.438 0 N-CA-C 107.701 -1.222 . . . . 3.09 107.701 176.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . 0.53 HD13 ' HA2' ' B' ' 549' ' ' GLY . 1.7 mp -63.77 -43.74 98.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.689 -0.687 . . . . 2.43 112.815 -176.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.04 93.23 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.392 -0.523 . . . . 1.01 112.301 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -62.4 -70.06 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 119.112 -1.035 . . . . 2.88 109.793 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -56.09 -23.84 36.41 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 116.608 2.077 . . . . 2.67 116.608 -176.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.1 p -121.68 25.25 9.38 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 114.201 1.186 . . . . 1.97 114.201 -178.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -48.46 -38.6 20.37 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 115.825 1.787 . . . . 4.07 115.825 -172.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 54.8 mtp180 -69.54 -32.63 71.55 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.201 0.815 . . . . 4.32 113.201 -175.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 598' ' ' HIS . . . . . 0.459 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 61.9 m-70 -70.2 -3.77 18.51 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.603 -0.726 . . . . 2.88 112.05 -173.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 599' ' ' PHE . . . . . 0.431 ' HZ ' HG22 ' B' ' 566' ' ' VAL . 3.2 m-85 -105.52 -16.95 14.57 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 123.597 0.561 . . . . 3.7 110.257 -176.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 15.0 p -105.76 -24.38 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.091 -0.959 . . . . 2.05 111.319 -175.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -102.03 139.51 37.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.578 -0.849 . . . . 2.81 111.55 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 16.1 m -60.89 122.71 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.611 -0.885 . . . . 1.99 108.611 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -92.78 167.29 11.96 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 123.648 0.592 . . . . 3.39 110.06 -177.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 42.9 t -71.93 128.93 35.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 N-CA-C 112.971 0.73 . . . . 1.91 112.971 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.38 6.53 64.38 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.062 -175.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 606' ' ' GLU . . . . . 0.457 ' HG2' ' H ' ' B' ' 608' ' ' MET . 34.7 tt0 -131.49 158.01 42.03 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.626 -0.83 . . . . 2.51 110.756 175.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 19.1 t -103.28 -22.55 4.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.055 -0.975 . . . . 2.03 112.451 -175.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 608' ' ' MET . . . . . 0.457 ' H ' ' HG2' ' B' ' 606' ' ' GLU . 96.4 mmm -136.96 142.21 37.67 Favored Pre-proline 0 C--O 1.222 -0.343 0 N-CA-C 112.615 0.598 . . . . 3.15 112.615 -174.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 609' ' ' PRO . . . . . 0.537 ' HB2' HG22 ' B' ' 611' ' ' ILE . 10.3 Cg_endo -52.13 130.85 36.91 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 120.83 1.02 . . . . 0.85 112.162 179.224 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -56.9 -31.85 65.3 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.866 0.321 . . . . 3.05 111.866 -174.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 611' ' ' ILE . . . . . 0.537 HG22 ' HB2' ' B' ' 609' ' ' PRO . 6.7 tp -50.0 -44.88 22.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 CA-C-O 120.787 0.327 . . . . 2.38 110.555 178.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 612' ' ' ASP . . . . . 0.439 ' OD1' ' HG2' ' B' ' 609' ' ' PRO . 0.9 OUTLIER -49.86 -52.0 36.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.612 0.765 . . . . 2.15 112.875 177.698 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -59.95 -37.13 78.67 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.606 -0.438 . . . . 2.66 110.175 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 62.7 mt -64.55 -47.96 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.117 -0.633 . . . . 2.28 111.968 178.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 615' ' ' LEU . . . . . 0.448 HD11 HD13 ' B' ' 618' ' ' ILE . 57.2 tp -62.6 -31.13 71.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.955 0.724 . . . . 2.38 112.955 -177.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -79.57 2.11 23.46 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.599 1.333 . . . . 2.62 114.599 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 617' ' ' ASN . . . . . 0.527 ' HB3' HG23 ' B' ' 620' ' ' THR . 12.3 m120 -142.48 15.79 2.01 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 113.104 0.779 . . . . 2.63 113.104 -174.259 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 618' ' ' ILE . . . . . 0.448 HD13 HD11 ' B' ' 615' ' ' LEU . 81.0 mt -46.93 -47.06 8.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 C-N-CA 118.929 -1.109 . . . . 2.47 110.177 -176.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 619' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -63.19 -51.1 67.7 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.703 1.001 . . . . 2.98 113.703 -176.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 620' ' ' THR . . . . . 0.527 HG23 ' HB3' ' B' ' 617' ' ' ASN . 8.8 t -56.94 -31.82 65.35 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.46 -0.896 . . . . 1.94 110.741 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 621' ' ' ILE . . . . . 0.519 HG13 ' HD1' ' B' ' 570' ' ' PHE . 15.7 tt -79.36 -42.67 23.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 115.267 1.58 . . . . 2.57 115.267 -178.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 622' ' ' ILE . . . . . 0.481 HG12 HG23 ' B' ' 630' ' ' VAL . 0.2 OUTLIER -87.7 -6.27 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.011 1.485 . . . . 2.61 115.011 -177.586 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.7 t -20.05 -58.28 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 116.538 2.051 . . . . 2.06 116.538 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -99.33 -7.53 26.16 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.061 -1.427 . . . . 2.07 111.007 -163.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 625' ' ' LEU . . . . . 0.649 HD13 ' HB3' ' B' ' 573' ' ' MET . 9.0 mp -71.87 146.85 47.64 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 123.326 0.391 . . . . 2.24 111.769 -173.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 626' ' ' GLN . . . . . 0.492 ' O ' HG22 ' B' ' 630' ' ' VAL . 11.8 pt20 -76.69 162.08 71.8 Favored Pre-proline 0 CA--C 1.519 -0.22 0 N-CA-C 108.843 -0.799 . . . . 2.99 108.843 174.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -47.86 -43.63 29.0 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.792 1.42 . . . . 0.86 115.792 -178.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -67.29 -43.07 82.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.573 -0.528 . . . . 3.24 109.573 -174.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 629' ' ' GLN . . . . . 0.453 ' HG3' ' SG ' ' B' ' 585' ' ' CYS . 1.1 mp0 -63.18 -38.37 90.89 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.934 -0.575 . . . . 2.79 110.928 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 630' ' ' VAL . . . . . 0.492 HG22 ' O ' ' B' ' 626' ' ' GLN . 59.8 t . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.207 -0.901 . . . . 1.93 110.687 176.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 112.525 -0.23 . . . . 10.09 112.525 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 78.0 p -85.6 -56.36 3.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.742 0.306 . . . . 8.94 110.978 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 58.52 88.03 0.07 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.207 -0.451 . . . . 7.08 111.377 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.7 t -74.85 -68.3 0.56 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 6.5 110.737 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -178.83 154.02 13.53 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.84 -0.695 . . . . 4.42 112.623 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -167.26 -38.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.905 0.383 . . . . 4.56 110.584 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.452 HD11 HD22 ' A' ' 10' ' ' LEU . 3.9 mm? -61.58 -15.59 40.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.948 -0.569 . . . . 2.59 111.25 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -64.78 -35.35 80.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 4.13 111.311 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -78.78 -23.71 45.08 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.415 -0.357 . . . . 4.17 110.727 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.452 HD22 HD11 ' A' ' 7' ' ' LEU . 9.6 mp -76.75 -13.37 60.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.144 -0.48 . . . . 3.01 110.727 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.02 -42.17 24.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.027 -0.533 . . . . 3.23 111.344 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.9 tp -59.61 -22.89 62.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.249 -0.432 . . . . 4.01 111.249 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.423 ' O ' HD23 ' B' ' 525' ' ' LEU . 75.0 mmtt -71.11 -48.25 53.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.381 -0.372 . . . . 5.26 110.901 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.459 HD22 HG21 ' B' ' 564' ' ' THR . 56.4 tp -57.44 -19.97 27.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.451 . . . . 3.63 111.154 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.601 ' HA ' ' HZ1' ' B' ' 568' ' ' LYS . . . -59.81 -15.36 20.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.267 -0.424 . . . . 3.49 111.278 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -103.78 79.33 0.31 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.93 -0.652 . . . . 3.04 112.535 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.2 tt -142.98 90.43 2.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.75 0.31 . . . . 2.53 110.492 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -85.76 162.53 18.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 3.92 110.847 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 13.9 tt -166.41 -37.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.506 . . . . 3.25 110.954 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.401 ' O ' ' N ' ' A' ' 22' ' ' THR . 27.2 t-20 -150.15 -88.68 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 6.51 110.756 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.667 ' HB2' ' HZ3' ' A' ' 21' ' ' LYS . 4.4 ttmp? 53.8 -87.7 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.467 -0.333 . . . . 9.65 111.143 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.401 ' N ' ' O ' ' A' ' 20' ' ' ASN . 88.8 m -128.0 -75.55 0.57 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.426 -0.352 . . . . 9.14 111.055 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 59.19 83.72 0.12 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.091 -0.504 . . . . 11.67 111.042 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -104.35 39.18 2.92 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.878 -0.677 . . . . 12.86 112.756 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -113.68 145.52 41.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.696 0.284 . . . . 15.37 110.804 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.75 -177.58 5.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.326 -0.397 . . . . 16.54 111.052 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 76.7 m . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.316 -0.85 . . . . 17.97 110.867 -179.987 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 39.5 pt . . . . . 0 C--O 1.236 0.342 0 N-CA-C 113.024 0.75 . . . . 2.63 113.024 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 80.5 p -48.89 119.18 3.01 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.576 0.584 . . . . 1.82 112.576 174.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.82 1.43 67.84 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 120.913 -0.66 . . . . 0.0 114.476 -179.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.33 -7.63 41.25 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 117.659 0.73 . . . . 1.02 112.431 176.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 86.4 mtp -112.41 159.96 18.2 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.29 0.478 . . . . 2.72 112.29 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -69.67 134.24 48.46 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 109.146 -0.687 . . . . 3.51 109.146 174.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -41.71 -35.42 0.78 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.37 0.878 . . . . 2.66 113.37 -173.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -73.84 -41.89 61.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.584 -0.734 . . . . 2.44 112.07 -176.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -64.83 -40.11 94.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.158 0.504 . . . . 2.08 110.88 171.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -53.72 -48.58 69.46 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.303 -0.862 . . . . 1.92 111.205 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -54.85 -57.6 10.94 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 111.9 0.333 . . . . 3.15 111.9 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -56.63 -35.93 68.9 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.157 0.911 . . . . 4.26 111.086 -177.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.507 ' O ' HG12 ' B' ' 520' ' ' VAL . 76.5 t80 -76.14 -45.56 33.01 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.104 -0.953 . . . . 2.37 110.504 -173.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 517' ' ' LEU . . . . . 0.533 ' HA ' HG21 ' B' ' 520' ' ' VAL . 8.5 tp -66.76 -32.23 73.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.731 -0.668 . . . . 2.46 112.591 177.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 518' ' ' VAL . . . . . . . . . . . . . 7.7 p -67.57 -35.07 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 118.483 -1.287 . . . . 2.02 109.021 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 42.8 m -72.9 -36.38 67.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.41 0.624 . . . . 1.82 112.444 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 520' ' ' VAL . . . . . 0.688 HG23 HG13 ' B' ' 521' ' ' ILE . 25.5 m -71.21 -42.3 75.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.395 -0.366 . . . . 1.86 111.636 -174.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 521' ' ' ILE . . . . . 0.688 HG13 HG23 ' B' ' 520' ' ' VAL . 82.4 mt -90.69 -25.86 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 N-CA-C 115.418 1.636 . . . . 2.46 115.418 -175.097 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -60.82 -35.16 75.81 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.717 -0.845 . . . . 2.99 108.717 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -92.4 -21.62 20.11 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.032 1.493 . . . . 2.17 115.032 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 524' ' ' LEU . . . . . 0.472 HD23 ' HB ' ' B' ' 544' ' ' ILE . 16.4 tp -70.53 -45.45 65.51 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 109.325 -0.621 . . . . 2.08 109.325 168.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . 0.445 HD13 HD13 ' A' ' 14' ' ' LEU . 43.2 tp -52.15 -45.52 65.06 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-O 121.211 0.529 . . . . 2.48 110.953 169.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.46 -40.57 94.42 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 52.2 tp -63.53 -36.16 82.87 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.057 0.456 . . . . 2.2 111.483 175.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 49.9 t -63.47 -47.74 80.58 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.012 -0.54 . . . . 1.05 110.705 -175.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -61.68 -29.65 70.22 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.508 -0.769 . . . . 2.5 112.56 173.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -71.65 -54.71 9.49 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.369 0.877 . . . . 2.83 113.369 -177.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -68.76 137.99 54.49 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.98 -0.555 . . . . 2.73 111.031 -177.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -96.49 160.72 14.25 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.749 -0.66 . . . . 4.81 110.19 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.64 1.35 Allowed Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.912 -0.585 . . . . 0.0 114.031 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -47.18 -36.61 8.89 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 113.175 0.805 . . . . 3.36 113.175 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -50.53 -51.86 43.88 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.376 -0.53 . . . . 2.2 110.823 174.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -66.05 -44.85 83.37 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.62 0.6 . . . . 2.09 112.62 178.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 537' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -67.87 -31.95 72.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.93 110.272 -174.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.12 -46.96 69.45 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 115.815 -0.629 . . . . 1.02 111.149 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 74.4 mt -58.24 -54.9 26.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 2.34 111.218 173.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 540' ' ' ILE . . . . . . . . . . . . . 47.0 mm -56.73 -48.17 81.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 2.37 110.601 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 541' ' ' ALA . . . . . 0.412 ' O ' ' CG2' ' B' ' 544' ' ' ILE . . . -57.48 -43.98 84.54 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 113.599 0.963 . . . . 0.69 113.599 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 542' ' ' SER . . . . . 0.561 ' HA ' ' HE1' ' B' ' 545' ' ' MET . 92.5 p -60.54 -38.7 85.31 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.557 -0.457 . . . . 1.63 110.301 -178.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -69.1 -47.07 66.14 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 114.298 1.221 . . . . 2.41 114.298 -175.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 544' ' ' ILE . . . . . 0.472 ' HB ' HD23 ' B' ' 524' ' ' LEU . 7.8 tt -52.6 -45.92 48.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 108.52 -0.919 . . . . 2.23 108.52 170.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 545' ' ' MET . . . . . 0.577 ' HE1' ' HG2' ' B' ' 583' ' ' MET . 74.5 mtm -64.03 -42.33 97.13 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.744 -0.782 . . . . 3.06 112.766 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -58.39 -48.73 79.68 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 119.224 -0.991 . . . . 2.36 109.838 176.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 36.1 mm -55.05 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.794 0.664 . . . . 2.07 112.794 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 548' ' ' VAL . . . . . 0.591 HG22 HD12 ' B' ' 555' ' ' LEU . 9.3 p -47.36 -44.21 8.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 C-N-CA 119.77 -0.772 . . . . 2.03 111.488 176.245 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 549' ' ' GLY . . . . . 0.404 ' N ' HG13 ' B' ' 548' ' ' VAL . . . -57.4 -28.05 58.85 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.845 -0.534 . . . . 0.0 112.908 -177.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 550' ' ' GLN . . . . . 0.431 ' C ' ' HD3' ' B' ' 552' ' ' PRO . 16.1 mm100 -87.06 -9.56 55.14 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.617 0.599 . . . . 2.85 112.617 -175.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -120.39 59.67 7.01 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.807 1.04 . . . . 3.84 113.807 -177.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 552' ' ' PRO . . . . . 0.431 ' HD3' ' C ' ' B' ' 550' ' ' GLN . 34.4 Cg_exo -55.98 -39.34 91.81 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.068 0.509 . . . . 0.89 113.152 177.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -56.3 -46.65 79.72 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 121.164 0.507 . . . . 4.49 109.997 -174.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -49.02 -59.64 3.45 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 123.931 0.892 . . . . 1.05 112.158 167.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 555' ' ' LEU . . . . . 0.591 HD12 HG22 ' B' ' 548' ' ' VAL . 82.2 mt -54.41 -48.51 71.53 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 116.271 -0.422 . . . . 2.09 110.195 -179.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . 0.544 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 56.0 ttt180 -53.98 -35.82 62.24 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.833 1.049 . . . . 3.63 113.833 -178.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.05 -12.18 50.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.538 -0.465 . . . . 1.0 112.106 -177.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 558' ' ' HIS . . . . . 0.411 ' CG ' ' HG ' ' A' ' 7' ' ' LEU . 51.0 m-70 -128.21 78.51 1.84 Allowed 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.393 1.257 . . . . 3.8 114.393 -177.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 5.6 m-90 -50.63 -48.22 58.15 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.492 2.034 . . . . 3.87 116.492 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -56.68 -36.56 69.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.423 . . . . 3.79 111.152 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 561' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -74.92 -45.12 44.7 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.126 -1.03 . . . . 1.8 111.882 175.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . 0.513 HD12 ' HB3' ' B' ' 555' ' ' LEU . 26.2 tp -50.01 -59.09 4.22 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 122.44 0.296 . . . . 1.94 110.314 175.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 563' ' ' LYS . . . . . 0.631 ' HZ3' ' HB3' ' B' ' 563' ' ' LYS . 8.4 mtpm? -50.24 -38.63 41.57 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.864 1.061 . . . . 3.16 113.864 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 564' ' ' THR . . . . . 0.459 HG21 HD22 ' A' ' 14' ' ' LEU . 89.9 m -71.73 -39.42 70.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.583 0.706 . . . . 1.88 110.413 -176.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 565' ' ' VAL . . . . . . . . . . . . . 59.3 t -62.81 -41.34 92.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 115.667 -0.697 . . . . 1.81 112.529 173.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 566' ' ' VAL . . . . . 0.449 HG22 ' O ' ' B' ' 562' ' ' LEU . 42.3 t -70.94 -50.82 40.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.49 -0.484 . . . . 2.0 110.873 -176.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -51.1 -37.48 46.12 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.075 -0.512 . . . . 2.53 111.978 170.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 568' ' ' LYS . . . . . 0.601 ' HZ1' ' HA ' ' A' ' 15' ' ' ALA . 25.5 mmtp -72.55 -32.73 66.31 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.723 -0.473 . . . . 3.93 109.723 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 569' ' ' LEU . . . . . 0.406 ' O ' ' HG3' ' B' ' 573' ' ' MET . 57.1 mt -67.52 -36.43 81.02 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 108.66 -0.867 . . . . 2.53 108.66 177.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -65.4 -39.38 92.11 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.859 -0.423 . . . . 4.72 109.859 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -57.69 -53.53 57.13 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.881 -0.727 . . . . 2.47 110.483 176.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -62.39 -9.89 9.7 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.158 1.17 . . . . 1.87 114.158 -177.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 573' ' ' MET . . . . . 0.594 ' HB3' HD12 ' B' ' 625' ' ' LEU . 26.5 mtm -76.42 -5.29 46.69 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.671 0.748 . . . . 2.56 109.667 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -109.49 -0.59 18.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.765 -1.107 . . . . 4.11 111.395 173.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 575' ' ' GLU . . . . . 0.439 ' HG2' HG12 ' B' ' 580' ' ' VAL . 18.6 tp10 -68.46 130.26 42.36 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.233 -0.44 . . . . 1.57 110.188 177.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 10.2 t -87.88 -21.34 25.04 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 112.947 0.721 . . . . 2.01 112.947 -177.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -60.17 128.01 34.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.48 0.657 . . . . 3.71 112.516 -175.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -44.81 125.83 5.28 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.391 -0.822 . . . . 2.15 113.095 -171.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.62 4.83 Favored Glycine 0 C--O 1.223 -0.57 0 N-CA-C 116.294 1.278 . . . . 0.0 116.294 174.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 580' ' ' VAL . . . . . 0.439 HG12 ' HG2' ' B' ' 575' ' ' GLU . 43.1 t -53.88 -46.35 63.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 113.057 0.762 . . . . 1.89 113.057 -175.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.605 ' H ' ' NE2' ' B' ' 581' ' ' GLN . 0.1 OUTLIER -59.64 -42.25 92.34 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.409 0.522 . . . . 2.46 112.409 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -60.54 -42.45 96.54 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.159 0.429 . . . . 2.23 112.159 172.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 583' ' ' MET . . . . . 0.646 ' HE1' ' HA ' ' B' ' 583' ' ' MET . 3.1 tpt -60.7 -49.53 77.15 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 121.058 -0.257 . . . . 3.01 110.416 175.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.89 80.29 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.181 -0.463 . . . . 1.01 111.744 -177.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 81.2 m -74.44 -40.92 61.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 119.976 -0.69 . . . . 2.2 111.938 -177.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 586' ' ' ASP . . . . . 0.462 ' O ' HG22 ' B' ' 589' ' ' ILE . 2.0 m-20 -59.6 -46.32 89.3 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.273 -0.421 . . . . 1.98 111.974 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 87.2 m -62.16 -41.22 98.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.92 110.43 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 588' ' ' PHE . . . . . 0.5 ' O ' HG23 ' B' ' 591' ' ' ILE . 87.8 t80 -61.4 -32.22 72.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.047 -0.524 . . . . 0.72 111.232 -177.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 589' ' ' ILE . . . . . 0.462 HG22 ' O ' ' B' ' 586' ' ' ASP . 9.7 tp -79.91 -35.99 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.871 -1.932 . . . . 2.46 109.74 -175.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . 0.418 ' N ' HG21 ' B' ' 589' ' ' ILE . 61.2 mttp -57.41 -50.04 74.3 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 107.752 -1.203 . . . . 3.09 107.752 176.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . 0.5 HG23 ' O ' ' B' ' 588' ' ' PHE . 12.2 tt -63.75 -43.72 98.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 112.885 0.698 . . . . 2.43 112.885 -177.062 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . 0.427 ' N ' HG22 ' B' ' 591' ' ' ILE . . . -63.94 -39.12 93.42 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.407 -0.517 . . . . 1.01 112.275 177.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -62.32 -70.08 0.22 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 119.113 -1.035 . . . . 2.88 109.848 174.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 594' ' ' LYS . . . . . 0.463 ' HD2' ' N ' ' B' ' 594' ' ' LYS . 13.5 mptt -56.15 -23.76 36.82 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 116.56 2.059 . . . . 2.67 116.56 -176.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.1 p -121.76 25.29 9.31 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.222 1.193 . . . . 1.97 114.222 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -48.61 -38.45 20.92 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.838 1.792 . . . . 4.07 115.838 -172.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 38.7 mmt180 -69.56 -32.61 71.5 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.202 0.816 . . . . 4.32 113.202 -175.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 598' ' ' HIS . . . . . 0.544 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 89.4 m-70 -70.21 -3.81 18.68 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.588 -0.733 . . . . 2.88 112.052 -173.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 599' ' ' PHE . . . . . 0.55 ' HB3' HG22 ' B' ' 611' ' ' ILE . 8.7 m-85 -105.64 -16.81 14.59 Favored 'General case' 0 CA--C 1.517 -0.301 0 O-C-N 123.621 0.576 . . . . 3.7 110.204 -176.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . 0.4 HG12 HD11 ' B' ' 611' ' ' ILE . 34.5 m -105.85 -24.37 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 115.084 -0.962 . . . . 2.05 111.355 -175.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -102.0 139.46 37.6 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 119.504 -0.879 . . . . 2.81 111.661 176.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 4.8 p -60.86 122.81 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 N-CA-C 108.639 -0.874 . . . . 1.99 108.639 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 603' ' ' GLN . . . . . 0.414 HE21 ' HB2' ' B' ' 603' ' ' GLN . 0.0 OUTLIER -92.88 167.33 11.91 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 123.645 0.591 . . . . 3.39 110.049 -177.589 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 30.8 t -71.91 128.81 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 113.022 0.749 . . . . 1.91 113.022 -175.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.46 6.57 64.2 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.062 -175.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 606' ' ' GLU . . . . . 0.54 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.0 tp10 -131.45 158.08 41.79 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.626 -0.83 . . . . 2.51 110.772 175.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 40.3 t -103.34 -22.57 4.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.04 -0.982 . . . . 2.03 112.527 -175.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 608' ' ' MET . . . . . 0.54 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 22.7 ptp -136.92 142.25 37.88 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.611 0.597 . . . . 3.15 112.611 -174.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.11 130.9 37.05 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.889 1.06 . . . . 0.85 112.085 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 610' ' ' PHE . . . . . 0.421 ' O ' HG12 ' B' ' 614' ' ' ILE . 16.4 t80 -57.04 -31.8 65.54 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.794 0.294 . . . . 3.05 111.794 -174.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 611' ' ' ILE . . . . . 0.55 HG22 ' HB3' ' B' ' 599' ' ' PHE . 8.9 pt -50.14 -44.71 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 120.811 0.339 . . . . 2.38 110.591 178.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -49.93 -52.05 36.32 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.666 0.786 . . . . 2.15 112.844 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -59.91 -37.09 78.45 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.562 -0.455 . . . . 2.66 110.241 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 614' ' ' ILE . . . . . 0.421 HG12 ' O ' ' B' ' 610' ' ' PHE . 24.5 mm -64.51 -47.97 86.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.934 0 C-N-CA 120.118 -0.633 . . . . 2.28 112.013 178.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 9.9 tt -62.69 -31.08 71.92 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.978 0.733 . . . . 2.38 112.978 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -79.54 2.12 23.36 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.621 1.341 . . . . 2.62 114.621 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 617' ' ' ASN . . . . . 0.609 ' C ' HD21 ' B' ' 617' ' ' ASN . 0.2 OUTLIER -142.44 15.68 2.02 Favored 'General case' 0 C--O 1.242 0.685 0 N-CA-C 113.138 0.792 . . . . 2.63 113.138 -174.235 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 618' ' ' ILE . . . . . 0.464 ' O ' HG12 ' B' ' 621' ' ' ILE . 10.5 tt -46.97 -46.99 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 C-N-CA 118.921 -1.112 . . . . 2.47 110.17 -176.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 619' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -63.2 -51.05 67.88 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 113.785 1.031 . . . . 2.98 113.785 -176.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 620' ' ' THR . . . . . 0.418 ' HG1' ' HB2' ' B' ' 617' ' ' ASN . 48.5 p -56.97 -31.83 65.42 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 119.432 -0.907 . . . . 1.94 110.708 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 621' ' ' ILE . . . . . 0.464 HG12 ' O ' ' B' ' 618' ' ' ILE . 27.7 pt -79.3 -42.68 23.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.282 1.586 . . . . 2.57 115.282 -178.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 622' ' ' ILE . . . . . 0.463 HG22 HG13 ' B' ' 621' ' ' ILE . 2.8 pp -87.72 -6.21 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 115.035 1.494 . . . . 2.61 115.035 -177.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 18.9 p -20.03 -58.34 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 116.493 2.035 . . . . 2.06 116.493 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.23 -7.58 26.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.011 -1.45 . . . . 2.07 111.022 -163.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 625' ' ' LEU . . . . . 0.594 HD12 ' HB3' ' B' ' 573' ' ' MET . 9.1 mp -71.83 146.9 47.69 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 123.3 0.375 . . . . 2.24 111.662 -173.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 626' ' ' GLN . . . . . 0.408 ' O ' HG22 ' B' ' 630' ' ' VAL . 1.8 mp0 -76.85 162.1 71.45 Favored Pre-proline 0 N--CA 1.464 0.254 0 N-CA-C 108.794 -0.817 . . . . 2.99 108.794 174.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -47.78 -43.67 28.48 Favored 'Trans proline' 0 C--O 1.233 0.256 0 N-CA-C 115.799 1.423 . . . . 0.86 115.799 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -67.24 -43.03 82.97 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.423 -0.511 . . . . 3.24 109.66 -174.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 629' ' ' GLN . . . . . 0.409 HE22 ' HB3' ' B' ' 581' ' ' GLN . 27.5 mt-30 -63.27 -38.34 90.78 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 115.98 -0.555 . . . . 2.79 110.923 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 630' ' ' VAL . . . . . 0.408 HG22 ' O ' ' B' ' 626' ' ' GLN . 97.8 t . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.163 -0.922 . . . . 1.93 110.722 176.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.196 0 N-CA-C 112.404 -0.278 . . . . 10.09 112.404 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.2 t -147.9 119.17 7.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.732 0.301 . . . . 8.94 110.866 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 56.16 78.67 0.19 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.096 -0.502 . . . . 7.08 111.097 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.4 m -98.17 22.89 8.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 6.5 110.823 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -85.88 48.39 3.96 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.717 -0.754 . . . . 4.42 112.466 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -138.32 -9.55 1.48 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.783 0.325 . . . . 4.56 110.995 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.611 HD21 ' HD1' ' B' ' 558' ' ' HIS . 1.7 tp -59.7 -19.71 51.56 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.221 -0.445 . . . . 2.59 110.9 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -58.4 -42.42 87.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.213 -0.449 . . . . 4.13 111.249 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -66.85 -20.83 66.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.828 0.347 . . . . 4.17 110.873 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.486 HD13 HD11 ' A' ' 7' ' ' LEU . 48.4 mt -78.72 -28.88 45.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.125 -0.488 . . . . 3.01 110.683 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.59 -36.8 79.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.476 . . . . 3.23 111.398 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.32 -9.97 59.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.277 -0.419 . . . . 4.01 111.407 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 37.3 tptt -80.45 -50.15 10.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.569 -0.287 . . . . 5.26 111.176 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.42 HD13 ' HG2' ' B' ' 568' ' ' LYS . 59.7 tp -79.46 -23.76 42.85 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.537 -0.301 . . . . 3.63 110.871 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.57 -16.12 45.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.285 -0.416 . . . . 3.49 111.281 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -126.61 39.05 2.06 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.89 -0.672 . . . . 3.04 112.606 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.46 ' HB3' ' HD3' ' B' ' 568' ' ' LYS . 62.4 tp -71.4 121.12 18.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.798 0.332 . . . . 2.53 110.431 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -98.37 169.34 9.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.084 -0.507 . . . . 3.92 111.378 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.612 HG13 ' HB2' ' B' ' 537' ' ' LYS . 13.8 tt -167.27 -34.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.685 -0.689 . . . . 3.25 110.363 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -115.87 19.5 15.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.962 -0.563 . . . . 6.51 110.514 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 97.2 mttt 60.2 172.74 0.09 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.922 -0.581 . . . . 9.65 111.295 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.4 p -133.53 -43.49 0.84 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.104 -0.498 . . . . 9.14 111.084 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -167.26 -15.07 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.133 -0.485 . . . . 11.67 110.93 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.27 136.46 5.41 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.849 -0.691 . . . . 12.86 112.593 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 57.14 89.21 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.894 0.378 . . . . 15.37 111.16 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -81.87 104.52 12.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.112 -0.495 . . . . 16.54 110.921 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.4 p . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.209 -0.9 . . . . 17.97 110.923 -179.975 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 504' ' ' ILE . . . . . 0.67 HD13 ' H2 ' ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.236 0.386 0 N-CA-C 113.063 0.764 . . . . 2.63 113.063 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 505' ' ' SER . . . . . 0.444 ' HB3' ' HG3' ' B' ' 550' ' ' GLN . 79.8 p -48.85 119.11 2.95 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.549 0.574 . . . . 1.82 112.549 174.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.88 1.43 67.69 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.964 -0.636 . . . . 0.0 114.407 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.55 41.43 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.646 0.723 . . . . 1.02 112.443 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 54.6 mtt -112.42 160.01 18.16 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 112.32 0.489 . . . . 2.72 112.32 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -69.78 134.21 48.3 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.131 -0.692 . . . . 3.51 109.131 174.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -41.72 -35.44 0.79 Allowed 'General case' 0 C--O 1.241 0.623 0 N-CA-C 113.361 0.874 . . . . 2.66 113.361 -173.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -73.67 -41.98 61.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.546 -0.752 . . . . 2.44 112.152 -176.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -64.83 -40.11 94.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.145 0.498 . . . . 2.08 110.885 171.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . 0.5 ' HG3' HD22 ' B' ' 517' ' ' LEU . 9.1 tp10 -53.71 -48.66 69.36 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.365 -0.834 . . . . 1.92 111.108 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 514' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' B' ' 517' ' ' LEU . 62.9 mttp -54.81 -57.57 11.05 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 111.918 0.34 . . . . 3.15 111.918 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -56.61 -36.0 68.93 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 124.201 0.938 . . . . 4.26 111.092 -177.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.447 ' O ' HG21 ' B' ' 520' ' ' VAL . 88.8 t80 -76.02 -45.64 33.45 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.06 -0.973 . . . . 2.37 110.554 -173.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 517' ' ' LEU . . . . . 0.555 HD11 ' N ' ' B' ' 518' ' ' VAL . 4.4 pp -66.63 -32.26 73.47 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.708 -0.678 . . . . 2.46 112.674 177.087 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 518' ' ' VAL . . . . . 0.555 ' N ' HD11 ' B' ' 517' ' ' LEU . 7.7 p -67.53 -35.09 72.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 118.483 -1.287 . . . . 2.02 109.047 178.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 60.8 p -73.01 -36.33 66.99 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.82 112.391 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 520' ' ' VAL . . . . . 0.447 HG21 ' O ' ' B' ' 516' ' ' PHE . 56.0 t -71.23 -42.37 75.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.46 -0.336 . . . . 1.86 111.611 -174.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 521' ' ' ILE . . . . . 0.419 HG21 ' O ' ' B' ' 517' ' ' LEU . 14.5 tt -90.64 -25.75 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.492 1.664 . . . . 2.46 115.492 -175.116 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -60.83 -35.28 76.15 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.683 -0.858 . . . . 2.99 108.683 173.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -92.36 -21.5 20.21 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.02 1.489 . . . . 2.17 115.02 -177.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 84.2 mt -70.58 -45.46 65.34 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 109.28 -0.637 . . . . 2.08 109.28 168.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 84.6 mt -52.18 -45.46 65.15 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-O 121.329 0.585 . . . . 2.48 110.97 169.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.5 -40.59 94.34 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 -178.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 67.2 mt -63.57 -36.07 82.6 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 2.2 111.47 175.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 528' ' ' CYS . . . . . 0.41 ' SG ' HD12 ' A' ' 17' ' ' LEU . 47.6 t -63.55 -47.73 80.37 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.08 -0.509 . . . . 1.05 110.661 -175.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -61.71 -29.59 70.2 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.508 -0.769 . . . . 2.5 112.589 173.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -71.61 -54.84 9.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.322 0.86 . . . . 2.83 113.322 -177.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 531' ' ' LYS . . . . . 0.441 ' O ' ' HD3' ' B' ' 537' ' ' LYS . 31.6 mmmt -68.71 137.87 54.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.994 -0.548 . . . . 2.73 111.047 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 19.1 ptt180 -96.37 160.67 14.29 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.79 -0.641 . . . . 4.81 110.149 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.39 119.58 1.34 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.841 -0.618 . . . . 0.0 114.008 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -47.06 -36.63 8.32 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.248 0.832 . . . . 3.36 113.248 177.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -50.53 -51.89 43.68 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.397 -0.521 . . . . 2.2 110.824 174.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 536' ' ' ASN . . . . . 0.424 ' O ' ' CG1' ' B' ' 539' ' ' ILE . 32.0 m-80 -65.98 -44.86 83.64 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.697 0.628 . . . . 2.09 112.697 178.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 537' ' ' LYS . . . . . 0.612 ' HB2' HG13 ' A' ' 19' ' ' ILE . 5.3 mmmm -67.84 -32.02 72.26 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.93 110.263 -174.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.03 -47.04 69.52 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 115.889 -0.596 . . . . 1.02 111.156 178.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 539' ' ' ILE . . . . . 0.454 HG13 ' N ' ' B' ' 540' ' ' ILE . 43.5 pt -58.15 -54.93 25.79 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 2.34 111.224 173.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 540' ' ' ILE . . . . . 0.454 ' N ' HG13 ' B' ' 539' ' ' ILE . 87.1 mt -56.85 -48.09 81.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 121.7 -0.625 . . . . 2.37 110.57 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 541' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' B' ' 537' ' ' LYS . . . -57.35 -44.17 84.1 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 113.678 0.992 . . . . 0.69 113.678 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 95.8 p -60.33 -38.83 84.97 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 120.658 -0.417 . . . . 1.63 110.294 -178.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -69.0 -47.12 66.28 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.339 1.237 . . . . 2.41 114.339 -175.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 544' ' ' ILE . . . . . 0.509 HG13 ' N ' ' B' ' 545' ' ' MET . 47.1 pt -52.69 -45.89 49.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.515 -0.921 . . . . 2.23 108.515 170.075 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 545' ' ' MET . . . . . 0.67 ' HB3' HG23 ' B' ' 587' ' ' THR . 77.0 mtm -64.06 -42.34 97.04 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.761 -0.776 . . . . 3.06 112.786 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -58.26 -48.82 79.23 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 119.279 -0.969 . . . . 2.36 109.857 176.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 28.9 mm -55.04 -61.41 1.05 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 112.862 0.69 . . . . 2.07 112.862 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 548' ' ' VAL . . . . . 0.409 HG22 ' HA ' ' B' ' 545' ' ' MET . 33.4 m -47.32 -44.18 8.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 C-N-CA 119.872 -0.731 . . . . 2.03 111.498 176.169 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.53 -27.95 59.07 Favored Glycine 0 C--N 1.331 0.285 0 O-C-N 121.835 -0.541 . . . . 0.0 112.851 -177.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 550' ' ' GLN . . . . . 0.444 ' HG3' ' HB3' ' B' ' 505' ' ' SER . 21.8 tp60 -87.13 -9.52 55.09 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.613 0.598 . . . . 2.85 112.613 -175.346 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 551' ' ' TYR . . . . . 0.4 ' O ' HD21 ' B' ' 555' ' ' LEU . 74.3 m-85 -120.36 59.72 6.98 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.809 1.04 . . . . 3.84 113.809 -177.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.01 -39.3 92.03 Favored 'Trans proline' 0 CA--C 1.53 0.298 0 O-C-N 122.127 0.54 . . . . 0.89 113.143 177.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 15.5 ptp180 -56.35 -46.71 79.84 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 121.095 0.474 . . . . 4.49 109.931 -174.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -48.89 -59.8 3.28 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 123.958 0.903 . . . . 1.05 112.113 167.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 555' ' ' LEU . . . . . 0.607 HD13 ' HA ' ' B' ' 562' ' ' LEU . 4.4 mm? -54.34 -48.51 71.33 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 116.242 -0.436 . . . . 2.09 110.236 -178.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 63.1 mtp180 -53.93 -35.79 62.09 Favored 'General case' 0 C--O 1.243 0.757 0 N-CA-C 113.828 1.047 . . . . 3.63 113.828 -178.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.13 -12.14 50.74 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.486 -0.486 . . . . 1.0 112.058 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 558' ' ' HIS . . . . . 0.611 ' HD1' HD21 ' A' ' 7' ' ' LEU . 86.8 m-70 -128.27 78.51 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.399 1.259 . . . . 3.8 114.399 -177.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 559' ' ' TRP . . . . . 0.492 ' O ' ' HG2' ' B' ' 563' ' ' LYS . 31.8 m-90 -50.46 -48.32 56.56 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 116.563 2.06 . . . . 3.87 116.563 -176.088 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -56.67 -36.6 69.77 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.314 -0.403 . . . . 3.79 111.13 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 561' ' ' PHE . . . . . 0.553 ' HB2' HD22 ' A' ' 7' ' ' LEU . 2.6 t80 -74.94 -45.08 44.83 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 119.087 -1.045 . . . . 1.8 111.847 175.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . 0.607 ' HA ' HD13 ' B' ' 555' ' ' LEU . 2.1 tt -50.0 -59.11 4.2 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.466 0.306 . . . . 1.94 110.29 175.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 563' ' ' LYS . . . . . 0.636 ' HG3' HE22 ' B' ' 603' ' ' GLN . 11.0 mmpt? -50.22 -38.67 41.48 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.863 1.061 . . . . 3.16 113.863 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 24.0 p -71.79 -39.33 69.98 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.495 0.664 . . . . 1.88 110.408 -176.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 565' ' ' VAL . . . . . 0.416 HG22 ' O ' ' B' ' 561' ' ' PHE . 97.9 t -62.83 -41.32 92.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.617 -0.72 . . . . 1.81 112.502 173.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 566' ' ' VAL . . . . . 0.517 HG13 ' N ' ' B' ' 567' ' ' ASN . 11.5 p -71.06 -50.74 40.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 C-N-CA 120.451 -0.499 . . . . 2.0 110.872 -176.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 567' ' ' ASN . . . . . 0.517 ' N ' HG13 ' B' ' 566' ' ' VAL . 6.7 t30 -51.13 -37.42 45.97 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.067 -0.515 . . . . 2.53 112.006 170.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 568' ' ' LYS . . . . . 0.564 ' HE2' ' HA ' ' B' ' 568' ' ' LYS . 0.3 OUTLIER -72.6 -32.7 66.17 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.746 -0.465 . . . . 3.93 109.746 -179.234 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 569' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' B' ' 573' ' ' MET . 4.1 mp -67.43 -36.52 81.39 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.67 -0.863 . . . . 2.53 108.67 177.103 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -65.38 -39.28 92.06 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.907 -0.405 . . . . 4.72 109.907 178.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.73 -53.47 57.79 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 119.921 -0.711 . . . . 2.47 110.51 176.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -62.49 -9.92 10.11 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.056 1.132 . . . . 1.87 114.056 -177.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 573' ' ' MET . . . . . 0.653 ' HB3' HD12 ' B' ' 625' ' ' LEU . 67.7 mtt -76.42 -5.31 46.75 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.618 0.723 . . . . 2.56 109.625 178.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 30.0 m-70 -109.42 -0.51 18.91 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.842 -1.072 . . . . 4.11 111.502 173.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 575' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -68.55 130.26 42.35 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.15 -0.477 . . . . 1.57 110.137 177.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 81.8 p -87.89 -21.27 25.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 112.981 0.734 . . . . 2.01 112.981 -177.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -60.2 128.01 34.67 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.411 0.624 . . . . 3.71 112.578 -175.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -44.9 125.88 5.4 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.388 -0.824 . . . . 2.15 113.103 -171.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.22 -34.64 4.82 Favored Glycine 0 C--O 1.223 -0.553 0 N-CA-C 116.242 1.257 . . . . 0.0 116.242 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 93.9 t -53.81 -46.27 63.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.232 0.827 . . . . 1.89 113.232 -175.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -59.77 -42.18 92.76 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.361 0.504 . . . . 2.46 112.361 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -60.56 -42.39 96.5 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.209 0.448 . . . . 2.23 112.209 172.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 26.4 mmt -60.76 -49.46 77.42 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 121.043 -0.263 . . . . 3.01 110.402 175.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.92 80.2 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.265 -0.425 . . . . 1.01 111.783 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 585' ' ' CYS . . . . . 0.416 ' O ' HG13 ' B' ' 589' ' ' ILE . 28.8 p -74.39 -40.98 61.7 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 120.066 -0.654 . . . . 2.2 111.929 -177.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -59.56 -46.35 89.16 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.209 -0.45 . . . . 1.98 111.962 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 587' ' ' THR . . . . . 0.67 HG23 ' HB3' ' B' ' 545' ' ' MET . 29.3 p -62.19 -41.23 98.14 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.298 0.639 . . . . 1.92 110.42 175.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -61.4 -32.25 72.18 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.059 -0.519 . . . . 0.72 111.177 -177.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 589' ' ' ILE . . . . . 0.416 HG13 ' O ' ' B' ' 585' ' ' CYS . 74.4 mt -79.81 -35.97 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 C-N-CA 116.91 -1.916 . . . . 2.46 109.831 -175.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -57.48 -49.99 74.49 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 107.717 -1.216 . . . . 3.09 107.717 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . 0.409 ' O ' ' SG ' ' B' ' 595' ' ' CYS . 49.0 mm -63.86 -43.71 97.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.697 -0.683 . . . . 2.43 112.779 -176.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.96 -39.13 93.44 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.512 -0.475 . . . . 1.01 112.252 177.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -62.34 -70.12 0.22 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 119.129 -1.029 . . . . 2.88 109.825 174.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -56.19 -23.65 36.62 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 116.617 2.08 . . . . 2.67 116.617 -176.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 595' ' ' CYS . . . . . 0.409 ' SG ' ' O ' ' B' ' 591' ' ' ILE . 1.4 p -121.79 25.29 9.29 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.189 1.181 . . . . 1.97 114.189 -178.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -48.54 -38.58 20.84 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 115.841 1.793 . . . . 4.07 115.841 -172.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -69.47 -32.64 71.68 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.302 0.852 . . . . 4.32 113.302 -175.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -70.19 -3.78 18.48 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.523 -0.762 . . . . 2.88 112.032 -173.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -105.6 -16.87 14.58 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.633 0.583 . . . . 3.7 110.197 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . 0.431 HG23 ' HG2' ' B' ' 601' ' ' GLN . 33.2 m -105.82 -24.39 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.037 -0.983 . . . . 2.05 111.327 -175.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 601' ' ' GLN . . . . . 0.431 ' HG2' HG23 ' B' ' 600' ' ' VAL . 14.2 mm100 -101.98 139.49 37.54 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.535 -0.866 . . . . 2.81 111.635 176.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 43.9 t -60.87 122.76 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 108.561 -0.903 . . . . 1.99 108.561 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 603' ' ' GLN . . . . . 0.636 HE22 ' HG3' ' B' ' 563' ' ' LYS . 11.5 pt20 -92.8 167.33 11.93 Favored 'General case' 0 C--O 1.224 -0.263 0 O-C-N 123.673 0.608 . . . . 3.39 110.116 -177.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 15.6 m -72.0 128.97 35.51 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 N-CA-C 112.98 0.733 . . . . 1.91 112.98 -175.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.33 6.57 64.43 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.11 -175.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 606' ' ' GLU . . . . . 0.541 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.3 tp10 -131.48 158.06 41.88 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.641 -0.824 . . . . 2.51 110.757 175.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 5.3 t -103.32 -22.58 4.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.036 -0.984 . . . . 2.03 112.472 -175.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 608' ' ' MET . . . . . 0.541 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 20.0 ptm -136.97 142.1 37.22 Favored Pre-proline 0 C--O 1.223 -0.297 0 N-CA-C 112.712 0.634 . . . . 3.15 112.712 -174.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 609' ' ' PRO . . . . . 0.527 ' HB2' HG21 ' B' ' 611' ' ' ILE . 9.6 Cg_endo -51.91 130.8 35.92 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 120.902 1.068 . . . . 0.85 112.202 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -57.0 -31.74 65.39 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.794 0.294 . . . . 3.05 111.794 -174.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 611' ' ' ILE . . . . . 0.527 HG21 ' HB2' ' B' ' 609' ' ' PRO . 12.2 tt -50.16 -44.74 23.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 CA-C-O 120.782 0.325 . . . . 2.38 110.493 178.287 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 612' ' ' ASP . . . . . 0.408 ' OD1' ' HG2' ' B' ' 609' ' ' PRO . 1.0 OUTLIER -50.04 -51.99 37.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.587 0.755 . . . . 2.15 112.849 177.72 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -59.88 -37.1 78.41 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.604 -0.438 . . . . 2.66 110.21 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 614' ' ' ILE . . . . . 0.439 ' O ' ' ND2' ' B' ' 617' ' ' ASN . 67.5 mt -64.6 -47.93 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 120.233 -0.587 . . . . 2.28 111.963 178.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 51.7 tp -62.66 -31.19 72.01 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.946 0.721 . . . . 2.38 112.946 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -79.47 2.12 23.14 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.632 1.345 . . . . 2.62 114.632 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 617' ' ' ASN . . . . . 0.46 ' C ' ' ND2' ' B' ' 617' ' ' ASN . 0.0 OUTLIER -142.47 15.79 2.01 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 113.141 0.793 . . . . 2.63 113.141 -174.248 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 618' ' ' ILE . . . . . 0.47 HG13 ' N ' ' B' ' 619' ' ' ASN . 19.7 pt -46.99 -47.06 8.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 C-N-CA 118.949 -1.1 . . . . 2.47 110.139 -176.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 619' ' ' ASN . . . . . 0.47 ' N ' HG13 ' B' ' 618' ' ' ILE . 3.3 p-10 -63.21 -51.05 67.85 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.769 1.026 . . . . 2.98 113.769 -176.355 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 620' ' ' THR . . . . . 0.402 HG21 ' ND2' ' B' ' 619' ' ' ASN . 62.9 p -56.89 -31.86 65.29 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 119.539 -0.864 . . . . 1.94 110.774 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 621' ' ' ILE . . . . . 0.46 HG13 HG21 ' B' ' 622' ' ' ILE . 49.2 pt -79.36 -42.6 23.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 115.385 1.624 . . . . 2.57 115.385 -179.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 622' ' ' ILE . . . . . 0.46 HG21 HG13 ' B' ' 621' ' ' ILE . 43.5 pt -87.74 -6.24 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 115.005 1.483 . . . . 2.61 115.005 -177.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 66.8 m -19.91 -58.38 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.543 2.053 . . . . 2.06 116.543 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -99.27 -7.63 26.13 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.983 -1.462 . . . . 2.07 111.022 -163.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 625' ' ' LEU . . . . . 0.653 HD12 ' HB3' ' B' ' 573' ' ' MET . 8.8 mp -71.84 146.93 47.64 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 123.289 0.368 . . . . 2.24 111.687 -173.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 626' ' ' GLN . . . . . 0.546 ' HB3' ' HD2' ' B' ' 627' ' ' PRO . 49.2 mt-30 -76.84 162.1 71.47 Favored Pre-proline 0 CA--C 1.518 -0.262 0 N-CA-C 108.818 -0.808 . . . . 2.99 108.818 174.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 627' ' ' PRO . . . . . 0.546 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 6.1 Cg_endo -47.84 -43.62 28.91 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.813 1.428 . . . . 0.86 115.813 -178.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 628' ' ' GLN . . . . . 0.51 ' NE2' ' H ' ' B' ' 628' ' ' GLN . 2.1 mp0 -67.28 -43.03 82.78 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.396 -0.522 . . . . 3.24 109.602 -174.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -63.25 -38.3 90.61 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.968 -0.56 . . . . 2.79 110.92 178.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 630' ' ' VAL . . . . . . . . . . . . . 93.5 t . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.22 -0.895 . . . . 1.93 110.644 176.742 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 112.399 -0.28 . . . . 10.09 112.399 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.5 p -91.95 128.06 37.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.698 0.285 . . . . 8.94 111.028 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -161.15 86.93 0.7 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 7.08 111.051 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.8 p -91.52 11.33 24.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 6.5 111.131 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 153.2 62.71 0.01 OUTLIER Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.736 -0.745 . . . . 4.42 112.502 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -114.68 -9.94 12.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.965 0.412 . . . . 4.56 110.78 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.452 HD12 HD12 ' A' ' 10' ' ' LEU . 1.9 tp -71.38 -17.68 62.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.02 -0.536 . . . . 2.59 110.874 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -66.38 -32.91 74.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.132 -0.486 . . . . 4.13 111.337 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -79.88 -18.7 50.02 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.303 -0.408 . . . . 4.17 111.245 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.452 HD12 HD12 ' A' ' 7' ' ' LEU . 20.8 mt -76.35 -35.84 58.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 3.01 110.912 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.72 -40.53 69.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.091 -0.504 . . . . 3.23 111.559 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 65.0 tp -62.86 -21.58 66.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.312 -0.404 . . . . 4.01 111.16 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -79.31 -26.69 42.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.43 . . . . 5.26 111.109 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.5 tp -64.4 -18.42 64.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.392 -0.367 . . . . 3.63 111.054 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.7 -27.74 63.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.244 -0.435 . . . . 3.49 111.28 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -85.41 88.39 1.58 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.699 -0.762 . . . . 3.04 112.576 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -159.81 94.75 1.15 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.855 0.36 . . . . 2.53 110.506 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -130.62 140.89 50.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.063 -0.517 . . . . 3.92 110.816 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.45 HD11 ' HA ' ' B' ' 538' ' ' ALA . 17.3 mt -134.88 68.67 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.337 -0.392 . . . . 3.25 110.802 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -134.23 146.99 50.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.154 -0.476 . . . . 6.51 110.989 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -151.36 88.37 1.43 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.98 -0.555 . . . . 9.65 110.248 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.7 p 53.99 -176.25 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.064 -0.516 . . . . 9.14 111.364 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 36.86 69.23 0.22 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.064 -0.516 . . . . 11.67 111.727 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -105.2 -78.34 1.2 Allowed Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.792 -0.718 . . . . 12.86 112.553 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -75.4 -6.05 48.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.801 0.334 . . . . 15.37 110.867 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -96.74 -59.87 1.72 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.161 -0.472 . . . . 16.54 110.877 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.5 t . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.276 -0.869 . . . . 17.97 111.075 -179.889 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 504' ' ' ILE . . . . . 0.659 HD11 ' H1 ' ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.291 0 N-CA-C 113.112 0.782 . . . . 2.63 113.112 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 77.9 p -48.89 119.2 3.02 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.548 0.573 . . . . 1.82 112.548 174.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.78 1.51 67.89 Favored Glycine 0 CA--C 1.526 0.741 0 C-N-CA 120.948 -0.644 . . . . 0.0 114.468 -179.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.52 41.51 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.653 0.727 . . . . 1.02 112.456 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 508' ' ' MET . . . . . 0.431 ' HE3' HG12 ' B' ' 504' ' ' ILE . 3.8 mpp? -112.5 160.02 18.2 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 121.196 0.522 . . . . 2.72 112.214 174.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 509' ' ' HIS . . . . . 0.428 ' HD1' ' HB3' ' B' ' 511' ' ' GLU . 55.0 t-80 -69.78 134.19 48.29 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.056 -0.72 . . . . 3.51 109.056 174.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 510' ' ' GLU . . . . . 0.481 ' O ' ' HG3' ' B' ' 514' ' ' LYS . 38.7 mt-10 -41.62 -35.33 0.73 Allowed 'General case' 0 C--O 1.24 0.565 0 N-CA-C 113.498 0.925 . . . . 2.66 113.498 -173.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 511' ' ' GLU . . . . . 0.428 ' HB3' ' HD1' ' B' ' 509' ' ' HIS . 41.8 tt0 -73.87 -41.94 61.49 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.485 -0.78 . . . . 2.44 112.086 -176.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -64.93 -40.03 94.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.133 0.492 . . . . 2.08 110.862 171.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -53.77 -48.55 69.65 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.344 -0.843 . . . . 1.92 111.155 177.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 514' ' ' LYS . . . . . 0.481 ' HG3' ' O ' ' B' ' 510' ' ' GLU . 67.1 mttm -54.92 -57.62 10.92 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 116.476 -0.329 . . . . 3.15 111.852 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . 0.413 ' O ' HG22 ' B' ' 518' ' ' VAL . 5.8 tmm_? -56.59 -35.97 68.84 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.173 0.921 . . . . 4.26 111.086 -177.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -76.06 -45.59 33.42 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.118 -0.947 . . . . 2.37 110.535 -173.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 517' ' ' LEU . . . . . 0.499 ' HA ' HG11 ' B' ' 520' ' ' VAL . 4.5 mm? -66.75 -32.23 73.39 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.742 -0.663 . . . . 2.46 112.627 177.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 518' ' ' VAL . . . . . 0.445 HG12 ' O ' ' B' ' 514' ' ' LYS . 35.9 m -67.48 -35.17 72.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 118.535 -1.266 . . . . 2.02 109.034 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 42.2 m -72.89 -36.42 67.33 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.428 0.633 . . . . 1.82 112.42 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 520' ' ' VAL . . . . . 0.499 HG11 ' HA ' ' B' ' 517' ' ' LEU . 7.1 p -71.19 -42.32 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 O-C-N 122.115 -0.366 . . . . 1.86 111.663 -174.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 521' ' ' ILE . . . . . 0.469 HG22 ' O ' ' B' ' 517' ' ' LEU . 14.3 tt -90.71 -25.7 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.473 1.657 . . . . 2.46 115.473 -175.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 6.1 tmmm? -60.86 -35.24 76.09 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.666 -0.864 . . . . 2.99 108.666 173.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -92.41 -21.54 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.008 1.484 . . . . 2.17 115.008 -177.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 80.5 mt -70.52 -45.44 65.56 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.315 -0.624 . . . . 2.08 109.315 168.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 85.0 mt -52.23 -45.42 65.28 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-O 121.273 0.559 . . . . 2.48 110.971 169.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.56 -40.48 94.21 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 -178.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 66.3 mt -63.7 -36.08 82.67 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.021 0.439 . . . . 2.2 111.382 175.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 40.7 t -63.47 -47.74 80.55 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.104 -0.498 . . . . 1.05 110.706 -175.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.7 -29.64 70.23 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.446 -0.797 . . . . 2.5 112.578 173.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -71.58 -54.76 9.43 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 113.384 0.883 . . . . 2.83 113.384 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -68.75 137.87 54.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.937 -0.574 . . . . 2.73 111.047 -177.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 532' ' ' ARG . . . . . 0.566 ' HD3' ' HZ1' ' B' ' 537' ' ' LYS . 21.7 tpp180 -96.42 160.73 14.25 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.798 -0.637 . . . . 4.81 110.166 178.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.62 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.854 -0.612 . . . . 0.0 114.022 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -47.08 -36.66 8.46 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.196 0.813 . . . . 3.36 113.196 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -50.51 -51.86 43.75 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 120.367 -0.533 . . . . 2.2 110.857 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 536' ' ' ASN . . . . . 0.426 ' O ' HG23 ' B' ' 539' ' ' ILE . 0.2 OUTLIER -66.13 -44.78 83.23 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.603 0.594 . . . . 2.09 112.603 178.359 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 537' ' ' LYS . . . . . 0.566 ' HZ1' ' HD3' ' B' ' 532' ' ' ARG . 62.6 mttp -67.87 -31.94 72.09 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.93 110.272 -174.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . 0.45 ' HA ' HD11 ' A' ' 19' ' ' ILE . . . -68.17 -46.96 69.29 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.886 -0.597 . . . . 1.02 111.092 178.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 539' ' ' ILE . . . . . 0.467 HG22 ' N ' ' B' ' 540' ' ' ILE . 8.2 tp -58.22 -54.91 26.09 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 2.34 111.247 173.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 540' ' ' ILE . . . . . 0.467 ' N ' HG22 ' B' ' 539' ' ' ILE . 48.4 mm -56.79 -48.06 81.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 2.37 110.607 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.51 -44.06 84.72 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 113.645 0.98 . . . . 0.69 113.645 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 542' ' ' SER . . . . . 0.473 ' HA ' ' HE3' ' B' ' 545' ' ' MET . 94.9 p -60.35 -38.88 85.22 Favored 'General case' 0 C--O 1.22 -0.478 0 C-N-CA 120.6 -0.44 . . . . 1.63 110.3 -178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -68.95 -47.17 66.33 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 114.323 1.231 . . . . 2.41 114.323 -175.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 544' ' ' ILE . . . . . 0.416 HG22 HG13 ' B' ' 521' ' ' ILE . 85.2 mt -52.55 -45.94 47.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.586 -0.894 . . . . 2.23 108.586 169.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 545' ' ' MET . . . . . 0.473 ' HE3' ' HA ' ' B' ' 542' ' ' SER . 74.2 mtm -64.03 -42.29 97.14 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.763 -0.775 . . . . 3.06 112.818 179.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -58.34 -48.8 79.42 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 119.234 -0.986 . . . . 2.36 109.838 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 95.0 mt -55.07 -61.41 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 112.846 0.684 . . . . 2.07 112.846 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 548' ' ' VAL . . . . . 0.567 HG22 HD23 ' B' ' 555' ' ' LEU . 10.5 p -47.36 -44.21 8.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.838 -0.745 . . . . 2.03 111.442 176.213 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 549' ' ' GLY . . . . . 0.515 ' HA2' HD13 ' B' ' 591' ' ' ILE . . . -57.41 -28.08 58.9 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -87.01 -9.53 55.33 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 112.629 0.604 . . . . 2.85 112.629 -175.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -120.46 59.66 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.796 1.035 . . . . 3.84 113.796 -176.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 552' ' ' PRO . . . . . 0.531 ' HG3' ' HG2' ' B' ' 594' ' ' LYS . 13.3 Cg_endo -55.93 -39.43 91.19 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 O-C-N 122.087 0.52 . . . . 0.89 113.114 177.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -56.26 -46.77 79.52 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 121.145 0.498 . . . . 4.49 109.926 -174.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -48.98 -59.71 3.38 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 123.953 0.901 . . . . 1.05 112.046 168.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 555' ' ' LEU . . . . . 0.58 HD11 ' HA ' ' B' ' 562' ' ' LEU . 4.3 mm? -54.3 -48.66 71.04 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 116.334 -0.394 . . . . 2.09 110.158 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . 0.528 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 21.3 ttm180 -53.87 -35.8 61.94 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.857 1.058 . . . . 3.63 113.857 -178.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.1 -12.22 50.64 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.48 -0.488 . . . . 1.0 112.043 -177.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 33.8 m80 -128.19 78.47 1.84 Allowed 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.404 1.261 . . . . 3.8 114.404 -177.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 47.1 p90 -50.47 -48.28 56.71 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 116.59 2.07 . . . . 3.87 116.59 -176.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -56.7 -36.61 69.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 3.79 111.099 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 561' ' ' PHE . . . . . 0.424 ' O ' HG22 ' B' ' 565' ' ' VAL . 1.7 t80 -74.91 -45.15 44.61 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 119.163 -1.015 . . . . 1.8 111.847 175.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . 0.58 ' HA ' HD11 ' B' ' 555' ' ' LEU . 5.5 tt -49.96 -59.18 4.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.498 0.319 . . . . 1.94 110.229 175.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 563' ' ' LYS . . . . . 0.443 ' HA ' HG23 ' B' ' 566' ' ' VAL . 39.7 tttm -50.2 -38.63 40.92 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.831 1.049 . . . . 3.16 113.831 178.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 23.3 p -71.81 -39.36 69.89 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.5 0.667 . . . . 1.88 110.366 -176.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 565' ' ' VAL . . . . . 0.424 HG22 ' O ' ' B' ' 561' ' ' PHE . 99.6 t -62.88 -41.28 92.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.628 -0.714 . . . . 1.81 112.49 173.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 566' ' ' VAL . . . . . 0.675 ' HA ' HD23 ' B' ' 569' ' ' LEU . 30.3 m -71.01 -50.9 39.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 C-N-CA 120.485 -0.486 . . . . 2.0 110.793 -176.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 567' ' ' ASN . . . . . 0.45 ' N ' HG22 ' B' ' 566' ' ' VAL . 15.3 m120 -51.07 -37.38 45.23 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 116.002 -0.545 . . . . 2.53 112.007 170.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 568' ' ' LYS . . . . . 0.401 ' HE2' ' HB3' ' B' ' 568' ' ' LYS . 29.8 ttpt -72.64 -32.67 66.06 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.77 -0.456 . . . . 3.93 109.77 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 569' ' ' LEU . . . . . 0.675 HD23 ' HA ' ' B' ' 566' ' ' VAL . 0.2 OUTLIER -67.5 -36.49 81.17 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.687 -0.857 . . . . 2.53 108.687 177.058 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 570' ' ' PHE . . . . . 0.523 ' HD1' HG13 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.38 -39.27 92.05 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.907 -0.405 . . . . 4.72 109.907 178.346 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -57.74 -53.49 57.61 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.982 -0.687 . . . . 2.47 110.47 176.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 572' ' ' PHE . . . . . 0.62 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 22.6 m-85 -62.45 -9.98 10.17 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.118 1.155 . . . . 1.87 114.118 -177.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 573' ' ' MET . . . . . 0.495 ' HB3' HD23 ' B' ' 625' ' ' LEU . 35.5 mtt -76.38 -5.26 46.44 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.641 0.734 . . . . 2.56 109.651 178.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -109.44 -0.56 18.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.82 -1.082 . . . . 4.11 111.411 173.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 575' ' ' GLU . . . . . 0.62 ' HG2' ' HA ' ' B' ' 572' ' ' PHE . 29.4 mm-40 -68.53 130.23 42.25 Favored 'General case' 0 C--O 1.233 0.221 0 O-C-N 123.422 0.451 . . . . 1.57 110.077 177.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 82.7 p -87.84 -21.36 25.07 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 113.011 0.745 . . . . 2.01 113.011 -177.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -60.09 128.03 34.81 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.425 0.631 . . . . 3.71 112.532 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -44.96 125.84 5.42 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.332 -0.849 . . . . 2.15 113.119 -171.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.27 -34.69 4.8 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.219 1.247 . . . . 0.0 116.219 174.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 55.5 t -53.72 -46.42 62.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.13 0.789 . . . . 1.89 113.13 -175.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.53 ' HB3' HE22 ' B' ' 629' ' ' GLN . 66.3 mt-30 -59.57 -42.34 92.26 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.406 0.521 . . . . 2.46 112.406 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -60.53 -42.41 96.42 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 112.19 0.441 . . . . 2.23 112.19 172.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 6.9 tpt -60.7 -49.53 77.15 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 121.058 -0.257 . . . . 3.01 110.416 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.79 -42.93 80.32 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.181 -0.463 . . . . 1.01 111.692 -177.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 585' ' ' CYS . . . . . 0.42 ' O ' HG13 ' B' ' 589' ' ' ILE . 52.0 t -74.49 -40.87 61.55 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 119.976 -0.69 . . . . 2.2 111.91 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.54 -46.34 89.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.351 -0.386 . . . . 1.98 111.995 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 86.4 m -62.21 -41.22 98.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.92 110.381 175.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 588' ' ' PHE . . . . . 0.44 ' HB2' ' CD1' ' B' ' 569' ' ' LEU . 19.2 t80 -61.44 -32.23 72.2 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.089 -0.505 . . . . 0.72 111.146 -177.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 589' ' ' ILE . . . . . 0.42 HG13 ' O ' ' B' ' 585' ' ' CYS . 68.8 mt -79.86 -35.99 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.008 0 C-N-CA 116.902 -1.919 . . . . 2.46 109.773 -175.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -57.47 -50.04 74.32 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 107.717 -1.216 . . . . 3.09 107.717 176.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . 0.515 HD13 ' HA2' ' B' ' 549' ' ' GLY . 1.7 mp -63.77 -43.74 98.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.693 -0.685 . . . . 2.43 112.815 -177.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.95 -39.12 93.41 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.443 -0.503 . . . . 1.01 112.275 177.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -62.37 -70.02 0.22 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 119.096 -1.041 . . . . 2.88 109.834 174.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 594' ' ' LYS . . . . . 0.531 ' HG2' ' HG3' ' B' ' 552' ' ' PRO . 0.0 OUTLIER -56.14 -23.8 36.91 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 116.655 2.095 . . . . 2.67 116.655 -176.565 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 83.8 m -121.63 25.21 9.42 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.243 1.201 . . . . 1.97 114.243 -178.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -48.59 -38.49 20.9 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.792 1.775 . . . . 4.07 115.792 -172.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . 0.425 ' O ' ' HG2' ' B' ' 601' ' ' GLN . 38.5 mmt180 -69.52 -32.69 71.69 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.202 0.816 . . . . 4.32 113.202 -175.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 598' ' ' HIS . . . . . 0.528 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 31.3 m80 -70.13 -3.82 18.49 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.662 -0.699 . . . . 2.88 112.053 -173.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 599' ' ' PHE . . . . . 0.47 ' HB3' HG22 ' B' ' 611' ' ' ILE . 74.8 m-85 -105.52 -16.94 14.57 Favored 'General case' 0 CA--C 1.517 -0.295 0 O-C-N 123.669 0.606 . . . . 3.7 110.279 -176.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 10.0 p -105.81 -24.36 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.031 -0.986 . . . . 2.05 111.311 -175.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 601' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 30.3 pt20 -102.02 139.5 37.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.578 -0.849 . . . . 2.81 111.569 176.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 6.6 m -60.91 122.71 12.1 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.441 0 N-CA-C 108.599 -0.889 . . . . 1.99 108.599 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 603' ' ' GLN . . . . . 0.429 ' HB2' ' HE1' ' B' ' 610' ' ' PHE . 82.7 mm-40 -92.78 167.31 11.95 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 123.729 0.643 . . . . 3.39 110.048 -177.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 62.1 t -71.98 128.99 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 113.018 0.748 . . . . 1.91 113.018 -175.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.4 6.5 64.38 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.039 -175.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -131.5 158.08 41.83 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.651 -0.82 . . . . 2.51 110.788 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 607' ' ' VAL . . . . . 0.572 HG22 ' HG2' ' B' ' 608' ' ' MET . 19.0 m -103.29 -22.59 4.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.023 -0.989 . . . . 2.03 112.447 -175.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 608' ' ' MET . . . . . 0.572 ' HG2' HG22 ' B' ' 607' ' ' VAL . 94.1 mmm -136.99 142.22 37.62 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 112.649 0.611 . . . . 3.15 112.649 -174.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -52.07 130.84 36.65 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 120.899 1.066 . . . . 0.85 112.165 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 610' ' ' PHE . . . . . 0.429 ' HE1' ' HB2' ' B' ' 603' ' ' GLN . 7.8 m-85 -56.96 -31.8 65.39 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 111.874 0.324 . . . . 3.05 111.874 -174.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 611' ' ' ILE . . . . . 0.47 HG22 ' HB3' ' B' ' 599' ' ' PHE . 10.3 pt -50.07 -44.79 22.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-O 120.726 0.298 . . . . 2.38 110.548 178.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -50.01 -52.02 37.3 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.597 0.759 . . . . 2.15 112.821 177.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -59.96 -37.05 78.47 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.535 -0.466 . . . . 2.66 110.234 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 60.5 mt -64.44 -48.1 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 120.246 -0.582 . . . . 2.28 111.925 178.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 55.0 tp -62.61 -31.17 71.96 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.955 0.724 . . . . 2.38 112.955 -177.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -79.5 2.12 23.23 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.621 1.341 . . . . 2.62 114.621 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 617' ' ' ASN . . . . . 0.434 ' O ' HG22 ' B' ' 621' ' ' ILE . 38.8 m-80 -142.44 15.67 2.01 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.168 0.803 . . . . 2.63 113.168 -174.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 618' ' ' ILE . . . . . 0.446 HG13 ' N ' ' B' ' 619' ' ' ASN . 20.9 pt -46.92 -47.06 8.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 C-N-CA 118.957 -1.097 . . . . 2.47 110.127 -176.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 619' ' ' ASN . . . . . 0.446 ' N ' HG13 ' B' ' 618' ' ' ILE . 18.8 m120 -63.2 -51.05 67.89 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.787 1.032 . . . . 2.98 113.787 -176.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 42.0 m -56.92 -31.83 65.33 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 119.455 -0.898 . . . . 1.94 110.763 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 621' ' ' ILE . . . . . 0.523 HG13 ' HD1' ' B' ' 570' ' ' PHE . 15.0 tt -79.35 -42.61 23.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 115.355 1.613 . . . . 2.57 115.355 -179.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 622' ' ' ILE . . . . . 0.424 HG23 HG21 ' B' ' 621' ' ' ILE . 38.3 pt -87.73 -6.24 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 115.09 1.515 . . . . 2.61 115.09 -177.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.7 t -19.9 -58.39 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 116.598 2.073 . . . . 2.06 116.598 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -99.21 -7.56 26.33 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 113.981 -1.463 . . . . 2.07 111.056 -164.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 625' ' ' LEU . . . . . 0.565 HD22 HE21 ' B' ' 629' ' ' GLN . 90.2 mt -71.9 146.91 47.54 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.264 0.352 . . . . 2.24 111.654 -173.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 626' ' ' GLN . . . . . 0.421 ' O ' HG22 ' B' ' 630' ' ' VAL . 30.0 mm-40 -76.84 162.09 71.51 Favored Pre-proline 0 CA--C 1.519 -0.233 0 N-CA-C 108.773 -0.825 . . . . 2.99 108.773 174.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -47.83 -43.61 28.88 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.813 1.428 . . . . 0.86 115.813 -178.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.25 -43.01 82.97 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 120.423 -0.511 . . . . 3.24 109.686 -174.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 629' ' ' GLN . . . . . 0.565 HE21 HD22 ' B' ' 625' ' ' LEU . 25.2 mt-30 -63.35 -38.16 90.07 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.856 -0.611 . . . . 2.79 110.904 178.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 630' ' ' VAL . . . . . 0.421 HG22 ' O ' ' B' ' 626' ' ' GLN . 67.2 t . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.33 -0.843 . . . . 1.93 110.687 176.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.187 0 N-CA-C 112.558 -0.217 . . . . 10.09 112.558 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.8 t -151.91 79.65 1.26 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.84 0.352 . . . . 8.94 110.749 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.78 -22.45 46.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 7.08 111.126 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 84.2 p -149.94 -26.81 0.25 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.109 -0.496 . . . . 6.5 110.827 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 112.29 177.44 19.92 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.763 -0.732 . . . . 4.42 112.657 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -139.58 -11.86 1.17 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.88 0.371 . . . . 4.56 110.849 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.7 mp -77.98 -9.29 59.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.057 -0.52 . . . . 2.59 110.975 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -60.73 -26.79 67.44 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.299 -0.41 . . . . 4.13 111.179 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -78.55 -47.65 16.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.264 -0.425 . . . . 4.17 110.94 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.543 HD23 HG21 ' B' ' 518' ' ' VAL . 1.8 pp -73.94 -9.04 58.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 3.01 111.068 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.49 -16.14 60.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.953 0.406 . . . . 3.23 110.803 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 43.1 tp -70.84 -9.49 57.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.982 -0.554 . . . . 4.01 110.764 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -66.37 -50.53 63.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.043 -0.526 . . . . 5.26 111.997 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.13 -8.59 46.8 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.625 0.25 . . . . 3.63 111.362 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.09 -20.89 0.39 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.079 0.4 . . . . 3.49 112.079 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -152.32 136.34 5.38 Favored Glycine 0 C--N 1.332 0.359 0 C-N-CA 120.315 -0.945 . . . . 3.04 113.195 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.417 HD12 ' SG ' ' B' ' 528' ' ' CYS . 22.0 tp -137.62 157.62 46.11 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 110.263 -0.273 . . . . 2.53 110.263 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -117.04 105.43 12.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.769 0.319 . . . . 3.92 111.023 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 6.4 tp -130.36 -33.5 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.193 -0.458 . . . . 3.25 110.947 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -81.33 -57.83 3.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.14 -0.482 . . . . 6.51 111.157 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.454 ' HG2' HG22 ' A' ' 22' ' ' THR . 87.5 tttt -169.08 -55.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.227 -0.442 . . . . 9.65 110.699 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.454 HG22 ' HG2' ' A' ' 21' ' ' LYS . 81.6 p -129.63 173.58 10.48 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.131 -0.486 . . . . 9.14 110.998 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -96.11 -72.66 0.62 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.442 -0.345 . . . . 11.67 110.782 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 140.87 -115.82 1.07 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.743 -0.742 . . . . 12.86 112.595 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -139.98 142.45 36.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.774 0.321 . . . . 15.37 110.888 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -83.61 122.69 28.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.264 -0.425 . . . . 16.54 111.265 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.4 t . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.203 -0.903 . . . . 17.97 111.296 179.901 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 35.0 pt . . . . . 0 C--O 1.235 0.291 0 N-CA-C 113.06 0.763 . . . . 2.63 113.06 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 42.3 t -49.01 119.21 3.06 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.545 0.572 . . . . 1.82 112.545 174.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.79 1.5 67.87 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.995 -0.621 . . . . 0.0 114.418 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.31 -7.53 41.59 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.711 0.755 . . . . 1.02 112.443 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 24.6 mmt -112.46 159.96 18.23 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 121.123 0.487 . . . . 2.72 112.297 174.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -69.78 134.19 48.29 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.119 -0.697 . . . . 3.51 109.119 174.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -41.67 -35.4 0.76 Allowed 'General case' 0 C--O 1.24 0.567 0 N-CA-C 113.401 0.889 . . . . 2.66 113.401 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -73.74 -41.91 61.87 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.505 -0.771 . . . . 2.44 112.17 -176.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -64.9 -40.18 94.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.16 0.505 . . . . 2.08 110.831 171.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -53.61 -48.76 68.98 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.357 -0.838 . . . . 1.92 111.084 177.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -54.76 -57.66 10.66 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 111.917 0.34 . . . . 3.15 111.917 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . 0.414 ' O ' HG13 ' B' ' 518' ' ' VAL . 39.5 ttm180 -56.6 -35.93 68.83 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.132 0.895 . . . . 4.26 111.086 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.434 ' O ' HG21 ' B' ' 520' ' ' VAL . 56.7 t80 -76.14 -45.6 32.8 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.104 -0.953 . . . . 2.37 110.504 -173.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 517' ' ' LEU . . . . . 0.49 ' O ' HG12 ' B' ' 521' ' ' ILE . 93.6 mt -66.72 -32.1 73.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.685 -0.689 . . . . 2.46 112.752 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 518' ' ' VAL . . . . . 0.543 HG21 HD23 ' A' ' 10' ' ' LEU . 12.6 p -67.6 -35.03 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 118.456 -1.297 . . . . 2.02 109.075 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 40.6 p -73.01 -36.3 66.98 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.82 112.391 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 520' ' ' VAL . . . . . 0.434 HG21 ' O ' ' B' ' 516' ' ' PHE . 51.1 t -71.29 -42.22 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.416 -0.356 . . . . 1.86 111.716 -174.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 521' ' ' ILE . . . . . 0.49 HG12 ' O ' ' B' ' 517' ' ' LEU . 18.6 pt -90.78 -25.68 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 115.391 1.626 . . . . 2.46 115.391 -175.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 26.6 ttpp -60.91 -35.12 75.86 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.681 -0.859 . . . . 2.99 108.681 173.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -92.43 -21.52 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.991 1.478 . . . . 2.17 114.991 -177.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 524' ' ' LEU . . . . . 0.502 ' HG ' HD13 ' B' ' 540' ' ' ILE . 4.6 mp -70.63 -45.43 65.21 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.28 -0.637 . . . . 2.08 109.28 169.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 26.9 tp -52.15 -45.56 65.07 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.253 0.549 . . . . 2.48 110.953 169.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.43 -40.52 94.47 Favored Glycine 0 N--CA 1.445 -0.735 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . 0.526 HD13 HE21 ' B' ' 530' ' ' GLN . 39.6 tp -63.55 -36.12 82.73 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.035 0.445 . . . . 2.2 111.402 175.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 528' ' ' CYS . . . . . 0.417 ' SG ' HD12 ' A' ' 17' ' ' LEU . 41.8 t -63.49 -47.81 80.22 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 116.065 -0.516 . . . . 1.05 110.632 -175.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -61.73 -29.5 70.16 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.467 -0.788 . . . . 2.5 112.615 173.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 530' ' ' GLN . . . . . 0.526 HE21 HD13 ' B' ' 527' ' ' LEU . 10.3 tt0 -71.7 -54.76 9.27 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.336 0.865 . . . . 2.83 113.336 -177.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.73 137.95 54.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.014 -0.539 . . . . 2.73 111.099 -177.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 11.1 ptp180 -96.5 160.71 14.25 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.83 -0.623 . . . . 4.81 110.117 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.62 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.854 -0.612 . . . . 0.0 114.022 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -47.14 -36.58 8.64 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.207 0.817 . . . . 3.36 113.207 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -50.59 -51.77 45.29 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 120.373 -0.531 . . . . 2.2 110.846 174.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -66.14 -44.84 83.01 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.59 0.589 . . . . 2.09 112.59 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 537' ' ' LYS . . . . . 0.542 ' HA ' HG23 ' B' ' 540' ' ' ILE . 60.3 mttm -67.84 -32.0 72.22 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.93 110.263 -174.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.12 -46.91 69.58 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 115.832 -0.622 . . . . 1.02 111.137 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 78.8 mt -58.25 -54.91 26.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 2.34 111.247 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 540' ' ' ILE . . . . . 0.542 HG23 ' HA ' ' B' ' 537' ' ' LYS . 10.6 tp -56.73 -48.16 81.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 2.37 110.601 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 541' ' ' ALA . . . . . 0.424 ' N ' HG22 ' B' ' 540' ' ' ILE . . . -57.47 -44.04 84.52 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.573 0.953 . . . . 0.69 113.573 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 542' ' ' SER . . . . . 0.548 ' O ' ' HG2' ' B' ' 545' ' ' MET . 94.7 p -60.47 -38.74 85.21 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.574 -0.45 . . . . 1.63 110.296 -178.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -69.03 -47.14 66.16 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.316 1.228 . . . . 2.41 114.316 -175.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 544' ' ' ILE . . . . . 0.411 HG21 ' N ' ' B' ' 545' ' ' MET . 14.7 tt -52.64 -46.0 48.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.46 -0.941 . . . . 2.23 108.46 170.061 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 545' ' ' MET . . . . . 0.548 ' HG2' ' O ' ' B' ' 542' ' ' SER . 0.0 OUTLIER -64.04 -42.31 97.1 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.688 -0.805 . . . . 3.06 112.757 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -58.34 -48.76 79.52 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 119.213 -0.995 . . . . 2.36 109.867 176.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 547' ' ' ILE . . . . . 0.405 HG21 ' N ' ' B' ' 548' ' ' VAL . 1.7 mp -55.09 -61.38 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.854 0.687 . . . . 2.07 112.854 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 548' ' ' VAL . . . . . 0.571 HG22 HD11 ' B' ' 555' ' ' LEU . 9.9 p -47.29 -44.32 8.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.843 -0.743 . . . . 2.03 111.43 176.193 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 549' ' ' GLY . . . . . 0.405 ' N ' HG12 ' B' ' 548' ' ' VAL . . . -57.4 -28.02 58.81 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.764 -0.585 . . . . 0.0 112.934 -177.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 550' ' ' GLN . . . . . 0.439 ' C ' ' HD3' ' B' ' 552' ' ' PRO . 32.5 tt0 -87.06 -9.52 55.24 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.617 0.599 . . . . 2.85 112.617 -175.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -120.44 59.64 7.08 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 113.823 1.046 . . . . 3.84 113.823 -176.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 552' ' ' PRO . . . . . 0.552 ' HG2' ' HG2' ' B' ' 594' ' ' LYS . 44.2 Cg_exo -55.96 -39.4 91.41 Favored 'Trans proline' 0 C--O 1.222 -0.291 0 O-C-N 122.124 0.539 . . . . 0.89 113.151 177.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 553' ' ' ARG . . . . . 0.444 ' HA ' ' HE ' ' B' ' 556' ' ' ARG . 98.9 mtt180 -56.27 -46.68 79.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.164 0.507 . . . . 4.49 109.99 -174.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.04 -59.7 3.4 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 123.931 0.892 . . . . 1.05 112.108 167.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 555' ' ' LEU . . . . . 0.571 HD11 HG22 ' B' ' 548' ' ' VAL . 87.0 mt -54.4 -48.51 71.48 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 116.322 -0.399 . . . . 2.09 110.177 -178.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . 0.444 ' HE ' ' HA ' ' B' ' 553' ' ' ARG . 59.5 mtm180 -53.93 -35.87 62.16 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.827 1.047 . . . . 3.63 113.827 -178.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.03 -12.26 50.73 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.528 -0.469 . . . . 1.0 112.078 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 558' ' ' HIS . . . . . 0.553 ' ND1' ' HB2' ' B' ' 561' ' ' PHE . 8.5 t-160 -128.22 78.48 1.84 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.405 1.261 . . . . 3.8 114.405 -177.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 34.6 p90 -50.48 -48.29 56.8 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 116.526 2.047 . . . . 3.87 116.526 -176.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -56.71 -36.55 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.303 -0.408 . . . . 3.79 111.15 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 561' ' ' PHE . . . . . 0.553 ' HB2' ' ND1' ' B' ' 558' ' ' HIS . 9.0 t80 -74.96 -45.06 44.86 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 119.1 -1.04 . . . . 1.8 111.908 175.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . 0.559 HD12 ' HB3' ' B' ' 555' ' ' LEU . 62.3 tp -49.97 -59.22 4.09 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.515 0.326 . . . . 1.94 110.255 175.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 563' ' ' LYS . . . . . 0.427 ' O ' HG11 ' B' ' 566' ' ' VAL . 39.7 ttmt -50.16 -38.66 40.54 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.893 1.071 . . . . 3.16 113.893 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 23.5 p -71.71 -39.42 70.17 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.572 0.701 . . . . 1.88 110.412 -176.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 565' ' ' VAL . . . . . 0.4 HG23 ' O ' ' B' ' 561' ' ' PHE . 85.1 t -62.84 -41.34 92.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.646 -0.706 . . . . 1.81 112.527 173.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 566' ' ' VAL . . . . . 0.501 HG13 ' N ' ' B' ' 567' ' ' ASN . 13.1 p -70.96 -50.85 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.537 -0.465 . . . . 2.0 110.875 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 567' ' ' ASN . . . . . 0.501 ' N ' HG13 ' B' ' 566' ' ' VAL . 2.8 t-20 -51.04 -37.47 45.55 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.009 -0.541 . . . . 2.53 112.044 170.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -72.69 -32.63 65.93 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.716 -0.475 . . . . 3.93 109.716 -179.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 569' ' ' LEU . . . . . 0.479 ' O ' ' HG3' ' B' ' 573' ' ' MET . 60.1 mt -67.5 -36.41 81.02 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 108.696 -0.853 . . . . 2.53 108.696 177.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -65.35 -39.38 92.28 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.868 -0.419 . . . . 4.72 109.868 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -57.7 -53.51 57.38 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 119.985 -0.686 . . . . 2.47 110.495 176.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 572' ' ' PHE . . . . . 0.605 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 18.6 m-85 -62.44 -9.86 9.79 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.093 1.146 . . . . 1.87 114.093 -177.189 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 573' ' ' MET . . . . . 0.699 ' HB3' HD13 ' B' ' 625' ' ' LEU . 67.9 mtt -76.47 -5.26 46.7 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.637 0.732 . . . . 2.56 109.662 178.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -109.49 -0.57 18.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.765 -1.107 . . . . 4.11 111.492 173.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 575' ' ' GLU . . . . . 0.605 ' HG2' ' HA ' ' B' ' 572' ' ' PHE . 25.2 mm-40 -68.47 130.15 42.01 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.169 -0.469 . . . . 1.57 110.214 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 76.8 p -87.79 -21.41 25.12 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.941 0.719 . . . . 2.01 112.941 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -60.1 128.05 34.9 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.418 0.627 . . . . 3.71 112.584 -175.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -44.95 125.88 5.44 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.372 -0.831 . . . . 2.15 113.103 -171.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 579' ' ' GLY . . . . . 0.401 ' O ' ' HG2' ' B' ' 583' ' ' MET . . . 96.23 -34.74 4.76 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.195 1.238 . . . . 0.0 116.195 174.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 47.1 t -53.77 -46.22 62.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.173 0.805 . . . . 1.89 113.173 -175.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -59.75 -42.27 92.87 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.333 0.494 . . . . 2.46 112.333 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -60.53 -42.46 96.55 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 112.202 0.445 . . . . 2.23 112.202 172.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 583' ' ' MET . . . . . 0.536 ' HB3' ' SD ' ' B' ' 545' ' ' MET . 28.6 mmt -60.66 -49.47 77.37 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.99 -0.284 . . . . 3.01 110.475 175.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.97 80.32 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.197 -0.456 . . . . 1.01 111.722 -177.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 77.5 m -74.32 -41.02 61.82 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 120.078 -0.649 . . . . 2.2 111.949 -177.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 586' ' ' ASP . . . . . 0.474 ' O ' HG21 ' B' ' 589' ' ' ILE . 69.2 m-20 -59.56 -46.3 89.3 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 116.252 -0.431 . . . . 1.98 111.984 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 587' ' ' THR . . . . . 0.472 ' HG1' ' HG3' ' B' ' 545' ' ' MET . 73.7 m -62.19 -41.22 98.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.92 110.43 175.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -61.45 -32.23 72.2 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.085 -0.507 . . . . 0.72 111.177 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 589' ' ' ILE . . . . . 0.474 HG21 ' O ' ' B' ' 586' ' ' ASP . 10.0 tp -79.88 -35.95 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.835 -1.946 . . . . 2.46 109.74 -175.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . 0.433 ' N ' HG23 ' B' ' 589' ' ' ILE . 67.1 mttm -57.51 -50.02 74.44 Favored 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 107.697 -1.223 . . . . 3.09 107.697 176.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 74.6 mt -63.76 -43.85 98.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 123.345 0.658 . . . . 2.43 112.77 -177.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.08 93.37 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.417 -0.513 . . . . 1.01 112.331 177.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -62.35 -70.14 0.22 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 119.12 -1.032 . . . . 2.88 109.783 174.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 594' ' ' LYS . . . . . 0.552 ' HG2' ' HG2' ' B' ' 552' ' ' PRO . 0.0 OUTLIER -56.02 -23.79 35.27 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 116.69 2.107 . . . . 2.67 116.69 -176.564 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 74.3 m -121.74 25.26 9.34 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.249 1.203 . . . . 1.97 114.249 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 596' ' ' ARG . . . . . 0.479 ' HG3' ' HD3' ' B' ' 597' ' ' ARG . 24.3 ptt180 -48.48 -38.54 20.32 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.856 1.799 . . . . 4.07 115.856 -172.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . 0.479 ' HD3' ' HG3' ' B' ' 596' ' ' ARG . 0.5 OUTLIER -69.66 -32.53 71.24 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.225 0.824 . . . . 4.32 113.225 -175.512 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 51.8 m-70 -70.09 -3.86 18.54 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-N 115.581 -0.736 . . . . 2.88 112.054 -173.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -105.55 -16.93 14.57 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.613 0.571 . . . . 3.7 110.18 -176.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 33.8 m -105.82 -24.41 4.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 CA-C-N 115.114 -0.948 . . . . 2.05 111.242 -175.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 601' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 3.5 pt20 -101.95 139.49 37.51 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.56 -0.856 . . . . 2.81 111.635 176.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 48.9 t -60.89 122.66 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 108.596 -0.89 . . . . 1.99 108.596 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -92.67 167.3 11.99 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.649 0.593 . . . . 3.39 110.138 -177.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 40.5 t -71.99 129.03 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 119.87 -0.732 . . . . 1.91 112.968 -175.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.31 6.6 64.45 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.096 -175.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 606' ' ' GLU . . . . . 0.466 ' HG3' ' H ' ' B' ' 608' ' ' MET . 10.5 tp10 -131.46 157.98 42.05 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.667 -0.813 . . . . 2.51 110.841 175.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 33.9 m -103.24 -22.53 4.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.063 -0.972 . . . . 2.03 112.507 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 608' ' ' MET . . . . . 0.466 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 52.6 ttm -136.97 142.18 37.5 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.651 0.611 . . . . 3.15 112.651 -174.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 609' ' ' PRO . . . . . 0.459 ' HD2' ' HG3' ' B' ' 608' ' ' MET . 54.2 Cg_exo -52.11 130.96 37.28 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.89 1.06 . . . . 0.85 112.086 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -57.03 -31.86 65.58 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 123.183 0.302 . . . . 3.05 111.799 -174.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 611' ' ' ILE . . . . . . . . . . . . . 13.4 tt -49.92 -44.97 21.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 120.816 0.341 . . . . 2.38 110.538 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -49.86 -52.0 36.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.612 0.765 . . . . 2.15 112.875 177.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.02 -37.06 78.64 Favored 'General case' 0 C--O 1.244 0.802 0 C-N-CA 120.555 -0.458 . . . . 2.66 110.183 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 72.6 mt -64.53 -47.93 87.1 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 120.214 -0.594 . . . . 2.28 112.002 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 93.3 mt -62.67 -31.17 72.0 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.955 0.724 . . . . 2.38 112.955 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -79.5 2.12 23.23 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.621 1.341 . . . . 2.62 114.621 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 617' ' ' ASN . . . . . 0.591 ' HB2' HG21 ' B' ' 620' ' ' THR . 26.2 p30 -142.44 15.62 2.01 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.168 0.803 . . . . 2.63 113.168 -174.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 618' ' ' ILE . . . . . 0.479 HG13 ' N ' ' B' ' 619' ' ' ASN . 16.7 pt -46.9 -47.02 8.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.47 110.222 -176.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 619' ' ' ASN . . . . . 0.479 ' N ' HG13 ' B' ' 618' ' ' ILE . 7.3 t30 -63.12 -51.21 67.44 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 113.777 1.028 . . . . 2.98 113.777 -176.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 620' ' ' THR . . . . . 0.591 HG21 ' HB2' ' B' ' 617' ' ' ASN . 4.1 t -56.82 -31.87 65.16 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 119.445 -0.902 . . . . 1.94 110.785 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 621' ' ' ILE . . . . . 0.503 HG13 HG23 ' B' ' 622' ' ' ILE . 36.1 pt -79.26 -42.73 23.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 115.342 1.608 . . . . 2.57 115.342 -179.036 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 622' ' ' ILE . . . . . 0.503 HG23 HG13 ' B' ' 621' ' ' ILE . 39.5 pt -87.67 -6.32 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 115.031 1.493 . . . . 2.61 115.031 -177.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.3 t -19.9 -58.33 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 116.642 2.09 . . . . 2.06 116.642 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -99.35 -7.53 26.11 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.028 -1.442 . . . . 2.07 110.973 -163.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 625' ' ' LEU . . . . . 0.699 HD13 ' HB3' ' B' ' 573' ' ' MET . 9.5 mp -71.81 146.85 47.75 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.493 -0.321 . . . . 2.24 111.748 -173.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 626' ' ' GLN . . . . . 0.415 ' O ' HG22 ' B' ' 630' ' ' VAL . 24.8 mt-30 -76.73 162.09 71.69 Favored Pre-proline 0 N--CA 1.464 0.237 0 N-CA-C 108.843 -0.799 . . . . 2.99 108.843 174.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -47.81 -43.6 28.82 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.823 1.432 . . . . 0.86 115.823 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 628' ' ' GLN . . . . . 0.562 ' HA ' HE21 ' B' ' 628' ' ' GLN . 0.0 OUTLIER -67.33 -43.0 82.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.427 -0.509 . . . . 3.24 109.631 -174.621 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -63.31 -38.2 90.22 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.924 -0.58 . . . . 2.79 110.924 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 630' ' ' VAL . . . . . 0.415 HG22 ' O ' ' B' ' 626' ' ' GLN . 90.7 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.195 -0.907 . . . . 1.93 110.615 176.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.18 0 N-CA-C 112.399 -0.28 . . . . 10.09 112.399 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.1 m -91.47 138.23 31.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.784 0.326 . . . . 8.94 110.807 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.53 -176.83 0.12 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.08 -0.509 . . . . 7.08 111.267 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.2 m -153.54 25.9 0.51 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.992 -0.549 . . . . 6.5 110.732 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 167.95 159.22 13.13 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.784 -0.722 . . . . 4.42 112.348 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -141.63 -22.8 0.73 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.728 0.299 . . . . 4.56 111.004 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.425 HD13 HD23 ' A' ' 10' ' ' LEU . 20.3 tp -76.18 -18.22 59.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.284 -0.417 . . . . 2.59 110.905 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -76.74 -50.28 13.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.919 0.39 . . . . 4.13 110.801 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -76.13 -9.85 58.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.098 -0.501 . . . . 4.17 110.351 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.425 HD23 HD13 ' A' ' 7' ' ' LEU . 13.5 tp -62.95 -38.32 90.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.695 -0.684 . . . . 3.01 111.022 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.07 -10.33 59.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.138 -0.483 . . . . 3.23 111.519 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 24.9 tp -60.62 -22.91 64.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.345 -0.388 . . . . 4.01 110.943 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -80.39 -21.65 42.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.248 -0.433 . . . . 5.26 111.71 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.462 HD12 ' O ' ' A' ' 14' ' ' LEU . 2.2 tm? -51.96 -29.4 20.33 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.885 0.374 . . . . 3.63 110.505 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.24 -17.93 0.3 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.012 -0.54 . . . . 3.49 111.949 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -84.02 -122.78 0.96 Allowed Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.83 -0.7 . . . . 3.04 112.44 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 55.54 83.41 0.09 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.773 0.32 . . . . 2.53 110.716 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -95.73 153.31 17.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 3.92 110.924 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 18.1 tt -171.78 -18.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 3.25 110.887 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -65.56 94.63 0.19 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.214 -0.448 . . . . 6.51 110.763 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.485 ' HZ2' ' H ' ' B' ' 534' ' ' LYS . 13.8 ptmm? -165.38 137.83 4.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.404 -0.362 . . . . 9.65 111.136 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.0 p -116.63 -49.14 2.66 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.119 -0.491 . . . . 9.14 111.015 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 57.59 90.17 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.17 -0.468 . . . . 11.67 111.05 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 158.18 -93.71 0.13 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.873 -0.68 . . . . 12.86 112.425 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 54.75 77.48 0.2 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.794 0.33 . . . . 15.37 111.027 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -132.17 28.75 4.4 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.179 -0.464 . . . . 16.54 110.868 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 52.1 t . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.191 -0.909 . . . . 17.97 111.081 -179.954 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 504' ' ' ILE . . . . . 0.687 HD13 ' H2 ' ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.339 0 N-CA-C 113.069 0.766 . . . . 2.63 113.069 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 79.2 p -48.83 119.13 2.95 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.542 0.571 . . . . 1.82 112.542 174.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.82 1.43 67.85 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 120.926 -0.654 . . . . 0.0 114.477 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.53 41.5 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.627 0.714 . . . . 1.02 112.443 176.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 63.2 mtt -112.47 159.99 18.22 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.11 0.481 . . . . 2.72 112.221 174.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -69.79 134.25 48.34 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.061 -0.718 . . . . 3.51 109.061 174.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -41.62 -35.48 0.76 Allowed 'General case' 0 C--O 1.241 0.623 0 N-CA-C 113.39 0.885 . . . . 2.66 113.39 -173.283 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -73.8 -41.92 61.69 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.541 -0.754 . . . . 2.44 112.087 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -64.88 -40.1 94.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.111 0.482 . . . . 2.08 110.863 171.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -53.64 -48.71 69.12 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.38 -0.827 . . . . 1.92 111.141 177.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 514' ' ' LYS . . . . . 0.52 ' O ' HG12 ' B' ' 518' ' ' VAL . 39.0 ttmt -54.88 -57.56 11.11 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 111.93 0.345 . . . . 3.15 111.93 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . 0.413 ' O ' HG21 ' B' ' 518' ' ' VAL . 28.2 mmm180 -56.62 -35.94 68.89 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 124.221 0.951 . . . . 4.26 111.124 -177.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.465 ' O ' HG11 ' B' ' 520' ' ' VAL . 70.8 t80 -76.08 -45.58 33.34 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.101 -0.954 . . . . 2.37 110.515 -173.37 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 517' ' ' LEU . . . . . 0.572 ' HA ' HG22 ' B' ' 520' ' ' VAL . 3.1 tt -66.76 -32.24 73.41 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.755 -0.657 . . . . 2.46 112.606 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 518' ' ' VAL . . . . . 0.52 HG12 ' O ' ' B' ' 514' ' ' LYS . 34.2 m -67.53 -35.07 72.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 118.473 -1.291 . . . . 2.02 109.087 178.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 47.8 m -72.96 -36.35 67.13 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.295 0.569 . . . . 1.82 112.437 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 520' ' ' VAL . . . . . 0.572 HG22 ' HA ' ' B' ' 517' ' ' LEU . 22.0 m -71.23 -42.35 74.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.418 -0.355 . . . . 1.86 111.643 -174.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 521' ' ' ILE . . . . . 0.501 HG12 ' O ' ' B' ' 517' ' ' LEU . 30.5 pt -90.64 -25.75 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 115.487 1.662 . . . . 2.46 115.487 -175.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.88 -35.24 76.12 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.694 -0.854 . . . . 2.99 108.694 173.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -92.36 -21.49 20.21 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.037 1.495 . . . . 2.17 115.037 -177.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 5.2 mp -70.61 -45.33 65.46 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.305 -0.628 . . . . 2.08 109.305 168.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 44.5 tp -52.31 -45.46 65.57 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 121.236 0.541 . . . . 2.48 110.91 169.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . 0.43 ' O ' ' HG2' ' B' ' 529' ' ' GLU . . . -66.5 -40.56 94.33 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -178.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 74.6 mt -63.57 -36.12 82.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 2.2 111.47 175.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 42.4 t -63.5 -47.77 80.36 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.041 -0.527 . . . . 1.05 110.634 -175.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 529' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' B' ' 526' ' ' GLY . 10.9 pt-20 -61.58 -29.71 70.2 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.544 -0.753 . . . . 2.5 112.542 173.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -71.62 -54.74 9.43 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.375 0.88 . . . . 2.83 113.375 -177.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -68.76 137.95 54.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.0 -0.545 . . . . 2.73 111.07 -177.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -96.46 160.6 14.32 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.813 -0.631 . . . . 4.81 110.16 178.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.53 119.56 1.37 Allowed Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 115.848 -0.614 . . . . 0.0 114.007 179.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 534' ' ' LYS . . . . . 0.485 ' H ' ' HZ2' ' A' ' 21' ' ' LYS . 22.8 pttm -47.08 -36.63 8.42 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.241 0.83 . . . . 3.36 113.241 177.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -50.52 -51.92 43.3 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 120.33 -0.548 . . . . 2.2 110.851 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 536' ' ' ASN . . . . . 0.491 ' O ' HG23 ' B' ' 539' ' ' ILE . 18.7 m120 -65.95 -44.87 83.74 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.717 0.636 . . . . 2.09 112.717 178.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 537' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -67.76 -32.04 72.36 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.408 -0.517 . . . . 2.93 110.283 -174.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.13 -46.92 69.5 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.896 -0.593 . . . . 1.02 111.112 178.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 539' ' ' ILE . . . . . 0.494 ' CG2' ' N ' ' B' ' 540' ' ' ILE . 0.4 OUTLIER -58.19 -54.92 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.56 0.695 . . . . 2.34 111.307 173.42 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 540' ' ' ILE . . . . . 0.494 ' N ' ' CG2' ' B' ' 539' ' ' ILE . 82.4 mt -56.77 -48.18 81.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 2.37 110.566 -178.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.38 -44.05 84.1 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 113.68 0.993 . . . . 0.69 113.68 179.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 63.4 m -60.43 -38.76 85.11 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.619 -0.432 . . . . 1.63 110.351 -178.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 543' ' ' ASN . . . . . 0.414 ' O ' HG12 ' B' ' 547' ' ' ILE . 42.1 t30 -69.0 -47.14 66.23 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.316 1.228 . . . . 2.41 114.316 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 544' ' ' ILE . . . . . . . . . . . . . 57.6 mt -52.64 -45.96 48.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.471 -0.937 . . . . 2.23 108.471 170.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 545' ' ' MET . . . . . 0.697 ' HB3' HG22 ' B' ' 587' ' ' THR . 50.6 mtp -64.05 -42.24 97.11 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 119.718 -0.793 . . . . 3.06 112.828 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -58.37 -48.8 79.42 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 119.272 -0.971 . . . . 2.36 109.829 176.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 547' ' ' ILE . . . . . 0.505 ' O ' ' HG2' ' B' ' 550' ' ' GLN . 43.2 mm -55.06 -61.36 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.854 0.687 . . . . 2.07 112.854 179.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 548' ' ' VAL . . . . . 0.595 HG21 HD12 ' B' ' 555' ' ' LEU . 12.4 p -47.41 -44.23 9.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 C-N-CA 119.892 -0.723 . . . . 2.03 111.388 176.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.32 -28.1 58.68 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.799 -0.563 . . . . 0.0 112.916 -177.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 550' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' B' ' 547' ' ' ILE . 7.5 pt20 -87.08 -9.55 55.12 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.598 0.592 . . . . 2.85 112.598 -175.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -120.38 59.69 6.99 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.773 1.027 . . . . 3.84 113.773 -176.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 552' ' ' PRO . . . . . 0.438 ' HD3' ' C ' ' B' ' 550' ' ' GLN . 44.6 Cg_exo -55.96 -39.35 91.72 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.068 0.509 . . . . 0.89 113.139 177.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -56.32 -46.67 79.77 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.153 0.501 . . . . 4.49 109.968 -174.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -48.93 -59.79 3.3 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 123.956 0.902 . . . . 1.05 112.113 167.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 555' ' ' LEU . . . . . 0.595 HD12 HG21 ' B' ' 548' ' ' VAL . 77.4 mt -54.33 -48.6 71.2 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.281 -0.418 . . . . 2.09 110.17 -178.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . 0.417 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 46.5 ttp180 -53.91 -35.9 62.14 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.752 1.019 . . . . 3.63 113.752 -178.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.05 -12.13 51.02 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.513 -0.475 . . . . 1.0 112.08 -177.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 558' ' ' HIS . . . . . 0.471 ' ND1' ' HB2' ' B' ' 561' ' ' PHE . 18.7 t-160 -128.28 78.45 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.399 1.259 . . . . 3.8 114.399 -177.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 559' ' ' TRP . . . . . 0.564 ' HB2' ' NE2' ' B' ' 603' ' ' GLN . 17.2 p90 -50.39 -48.3 56.02 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 116.613 2.079 . . . . 3.87 116.613 -176.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 24.1 ttmm -56.6 -36.69 69.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.265 -0.425 . . . . 3.79 111.073 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 561' ' ' PHE . . . . . 0.525 ' O ' HG11 ' B' ' 565' ' ' VAL . 0.1 OUTLIER -74.91 -45.08 45.02 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.061 -1.055 . . . . 1.8 111.897 175.68 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . 0.49 ' O ' HG23 ' B' ' 565' ' ' VAL . 6.4 tt -49.94 -59.12 4.17 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 122.459 0.304 . . . . 1.94 110.338 175.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -50.22 -38.64 41.31 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.863 1.061 . . . . 3.16 113.863 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 37.8 m -71.81 -39.42 69.86 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.487 0.66 . . . . 1.88 110.294 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 565' ' ' VAL . . . . . 0.525 HG11 ' O ' ' B' ' 561' ' ' PHE . 4.8 m -62.85 -41.28 91.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.687 -0.688 . . . . 1.81 112.529 173.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 566' ' ' VAL . . . . . 0.565 HG23 HD11 ' B' ' 591' ' ' ILE . 47.9 t -71.06 -50.84 39.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 C-N-CA 120.537 -0.465 . . . . 2.0 110.798 -176.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -51.04 -37.42 45.26 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.035 -0.53 . . . . 2.53 112.067 170.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -72.72 -32.58 65.82 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.736 -0.468 . . . . 3.93 109.736 -179.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 569' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' B' ' 565' ' ' VAL . 71.3 mt -67.52 -36.53 81.23 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 108.648 -0.871 . . . . 2.53 108.648 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -65.29 -39.34 92.42 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.915 -0.402 . . . . 4.72 109.915 178.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.68 -53.58 56.63 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 120.011 -0.676 . . . . 2.47 110.465 176.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 572' ' ' PHE . . . . . 0.53 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 23.5 m-85 -62.44 -9.9 9.91 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.121 1.156 . . . . 1.87 114.121 -177.135 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 573' ' ' MET . . . . . 0.549 ' HB3' HD21 ' B' ' 625' ' ' LEU . 67.9 mtt -76.39 -5.34 46.86 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.648 0.737 . . . . 2.56 109.641 178.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -109.43 -0.57 18.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.815 -1.084 . . . . 4.11 111.431 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 575' ' ' GLU . . . . . 0.535 ' HB3' HG21 ' B' ' 580' ' ' VAL . 48.4 mm-40 -68.59 130.24 42.26 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 116.195 -0.457 . . . . 1.57 110.124 177.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 64.0 p -87.89 -21.21 25.1 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.026 0.75 . . . . 2.01 113.026 -177.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 577' ' ' HIS . . . . . 0.461 ' O ' HG23 ' B' ' 580' ' ' VAL . 64.7 t-80 -60.21 128.0 34.62 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.402 0.62 . . . . 3.71 112.528 -175.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -44.85 125.86 5.33 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.397 -0.82 . . . . 2.15 113.139 -171.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.72 4.76 Favored Glycine 0 C--O 1.223 -0.567 0 N-CA-C 116.299 1.28 . . . . 0.0 116.299 175.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 580' ' ' VAL . . . . . 0.535 HG21 ' HB3' ' B' ' 575' ' ' GLU . 23.5 m -53.81 -46.31 63.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.096 0.776 . . . . 1.89 113.096 -175.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -59.67 -42.3 92.56 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.371 0.508 . . . . 2.46 112.371 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -60.54 -42.4 96.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 112.232 0.456 . . . . 2.23 112.232 172.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 7.2 tpt -60.68 -49.51 77.21 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.084 -0.246 . . . . 3.01 110.453 175.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.7 -43.0 80.11 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.129 -0.487 . . . . 1.01 111.81 -177.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 50.2 t -74.35 -40.93 61.82 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.03 -0.668 . . . . 2.2 112.004 -177.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 586' ' ' ASP . . . . . 0.493 ' O ' HG21 ' B' ' 589' ' ' ILE . 0.7 OUTLIER -59.6 -46.29 89.4 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.249 -0.432 . . . . 1.98 111.974 -179.899 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 587' ' ' THR . . . . . 0.697 HG22 ' HB3' ' B' ' 545' ' ' MET . 41.7 p -62.23 -41.23 98.23 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.372 0.669 . . . . 1.92 110.358 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 588' ' ' PHE . . . . . 0.531 ' HA ' HG12 ' B' ' 591' ' ' ILE . 88.2 t80 -61.46 -32.15 72.14 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.118 -0.492 . . . . 0.72 111.186 -177.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 589' ' ' ILE . . . . . 0.493 HG21 ' O ' ' B' ' 586' ' ' ASP . 20.1 tt -79.87 -35.95 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.878 -1.929 . . . . 2.46 109.8 -175.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -57.56 -49.86 74.99 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 107.779 -1.193 . . . . 3.09 107.779 176.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . 0.565 HD11 HG23 ' B' ' 566' ' ' VAL . 34.5 pt -63.91 -43.64 97.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.784 0.661 . . . . 2.43 112.784 -176.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . 0.477 ' N ' HG13 ' B' ' 591' ' ' ILE . . . -63.94 -39.17 93.53 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.535 -0.466 . . . . 1.01 112.217 177.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 593' ' ' GLN . . . . . 0.463 HE21 ' HA ' ' B' ' 593' ' ' GLN . 0.0 OUTLIER -62.3 -70.14 0.22 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.14 -1.024 . . . . 2.88 109.795 174.518 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -56.13 -23.72 36.28 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 116.623 2.082 . . . . 2.67 116.623 -176.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 74.8 m -121.66 25.15 9.44 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 114.331 1.234 . . . . 1.97 114.331 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -48.5 -38.52 20.4 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.887 1.81 . . . . 4.07 115.887 -172.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . 0.418 ' O ' ' HG2' ' B' ' 601' ' ' GLN . 34.5 ttm180 -69.56 -32.63 71.52 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.242 0.831 . . . . 4.32 113.242 -175.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 598' ' ' HIS . . . . . 0.417 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 57.2 m-70 -70.07 -3.84 18.37 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.595 -0.73 . . . . 2.88 112.107 -173.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -105.54 -16.88 14.59 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 123.597 0.561 . . . . 3.7 110.231 -176.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 35.8 m -105.9 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.11 -0.95 . . . . 2.05 111.276 -175.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 601' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 3.9 pt20 -102.05 139.52 37.57 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 119.563 -0.855 . . . . 2.81 111.561 176.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 7.4 m -60.95 122.74 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.597 -0.89 . . . . 1.99 108.597 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 603' ' ' GLN . . . . . 0.564 ' NE2' ' HB2' ' B' ' 559' ' ' TRP . 18.9 pt20 -92.79 167.31 11.95 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.631 0.582 . . . . 3.39 110.048 -177.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 41.3 t -71.99 129.01 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 N-CA-C 112.958 0.725 . . . . 1.91 112.958 -175.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.35 6.52 64.44 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.059 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 606' ' ' GLU . . . . . 0.501 ' HG3' ' H ' ' B' ' 608' ' ' MET . 8.7 tp10 -131.44 157.97 42.06 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.639 -0.825 . . . . 2.51 110.808 175.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 607' ' ' VAL . . . . . 0.518 HG12 ' HG2' ' B' ' 608' ' ' MET . 13.9 p -103.26 -22.46 4.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.097 -0.956 . . . . 2.03 112.49 -175.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 608' ' ' MET . . . . . 0.518 ' HG2' HG12 ' B' ' 607' ' ' VAL . 22.2 mmt -137.02 142.22 37.57 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.601 0.593 . . . . 3.15 112.601 -174.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 609' ' ' PRO . . . . . 0.533 ' HB2' HG23 ' B' ' 611' ' ' ILE . 9.7 Cg_endo -52.08 130.9 36.93 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.85 112.131 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -57.0 -31.84 65.5 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 111.823 0.305 . . . . 3.05 111.823 -174.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 611' ' ' ILE . . . . . 0.533 HG23 ' HB2' ' B' ' 609' ' ' PRO . 14.0 tt -50.0 -44.93 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 CA-C-O 120.816 0.341 . . . . 2.38 110.496 178.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -49.88 -52.0 36.23 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.646 0.778 . . . . 2.15 112.875 177.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -59.95 -37.13 78.67 Favored 'General case' 0 C--O 1.244 0.795 0 C-N-CA 120.59 -0.444 . . . . 2.66 110.189 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 614' ' ' ILE . . . . . 0.401 ' O ' ' ND2' ' B' ' 617' ' ' ASN . 73.0 mt -64.45 -48.05 86.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 C-N-CA 120.262 -0.575 . . . . 2.28 111.973 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 59.8 tp -62.6 -31.13 71.91 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.03 0.752 . . . . 2.38 113.03 -177.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -79.6 2.16 23.4 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.639 1.348 . . . . 2.62 114.639 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 617' ' ' ASN . . . . . 0.595 ' C ' HD21 ' B' ' 617' ' ' ASN . 0.2 OUTLIER -142.42 15.67 2.02 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.117 0.784 . . . . 2.63 113.117 -174.283 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 618' ' ' ILE . . . . . 0.43 ' O ' HG12 ' B' ' 621' ' ' ILE . 13.5 tt -46.87 -46.98 8.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.47 110.263 -176.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 619' ' ' ASN . . . . . 0.411 ' N ' HG22 ' B' ' 618' ' ' ILE . 22.7 p-10 -63.24 -51.06 67.74 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.754 1.02 . . . . 2.98 113.754 -176.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 620' ' ' THR . . . . . 0.41 ' OG1' ' HB2' ' B' ' 617' ' ' ASN . 56.8 p -56.94 -31.9 65.43 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.46 -0.896 . . . . 1.94 110.741 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 621' ' ' ILE . . . . . 0.455 HG13 HG21 ' B' ' 622' ' ' ILE . 32.0 pt -79.27 -42.65 23.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.373 1.62 . . . . 2.57 115.373 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 622' ' ' ILE . . . . . 0.455 HG21 HG13 ' B' ' 621' ' ' ILE . 34.7 pt -87.67 -6.25 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 115.069 1.507 . . . . 2.61 115.069 -177.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 40.2 t -19.98 -58.32 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.567 2.062 . . . . 2.06 116.567 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.23 -7.65 26.16 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.037 -1.438 . . . . 2.07 110.994 -163.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 625' ' ' LEU . . . . . 0.549 HD21 ' HB3' ' B' ' 573' ' ' MET . 82.7 mt -71.78 146.9 47.78 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 123.311 0.382 . . . . 2.24 111.773 -173.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 626' ' ' GLN . . . . . 0.545 ' HB3' ' HD2' ' B' ' 627' ' ' PRO . 97.2 mt-30 -76.75 162.1 71.64 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 108.827 -0.805 . . . . 2.99 108.827 174.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 627' ' ' PRO . . . . . 0.545 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 6.3 Cg_endo -47.85 -43.55 29.14 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.823 1.432 . . . . 0.86 115.823 -178.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -67.32 -43.08 82.52 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.615 -0.513 . . . . 3.24 109.615 -174.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -63.29 -38.29 90.58 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.951 -0.568 . . . . 2.79 110.9 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 630' ' ' VAL . . . . . . . . . . . . . 80.9 t . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.237 -0.887 . . . . 1.93 110.67 176.746 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.466 -0.254 . . . . 10.09 112.466 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.9 t -135.69 111.55 9.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.752 0.31 . . . . 8.94 110.799 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.71 128.69 39.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 7.08 111.126 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.4 p -64.37 130.06 42.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 6.5 111.054 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.74 120.86 0.36 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.791 -0.719 . . . . 4.42 112.587 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -101.22 -45.74 5.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.722 0.296 . . . . 4.56 110.925 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.578 ' HG ' HD21 ' A' ' 10' ' ' LEU . 7.4 mp -73.32 -8.98 58.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.279 -0.419 . . . . 2.59 110.891 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -54.89 -41.96 71.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.064 -0.517 . . . . 4.13 111.232 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -79.97 -22.65 42.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.309 -0.405 . . . . 4.17 111.056 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.578 HD21 ' HG ' ' A' ' 7' ' ' LEU . 10.8 mp -63.58 -23.72 67.5 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.182 -0.463 . . . . 3.01 111.047 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.02 -31.63 44.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 3.23 111.374 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 24.7 tp -67.13 -18.36 65.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.817 0.341 . . . . 4.01 110.715 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -80.71 -39.08 27.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.139 -0.482 . . . . 5.26 111.491 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.507 HD22 ' HD3' ' B' ' 568' ' ' LYS . 8.5 tt -60.1 -24.77 64.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.482 -0.326 . . . . 3.63 110.916 -179.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.42 -30.99 54.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 3.49 111.093 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -94.54 58.43 1.91 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.761 -0.733 . . . . 3.04 112.437 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.456 HD22 ' HD2' ' B' ' 568' ' ' LYS . 14.3 tp -140.02 102.2 4.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.016 0.436 . . . . 2.53 110.819 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -155.35 140.67 17.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.857 -0.61 . . . . 3.92 110.755 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 15.7 mm -78.56 -13.75 13.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 3.25 110.875 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -148.31 134.96 19.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.128 -0.487 . . . . 6.51 110.764 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -74.55 104.5 5.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.324 -0.398 . . . . 9.65 110.735 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.7 m -94.94 130.63 41.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.141 -0.482 . . . . 9.14 111.149 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -73.13 96.63 2.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.246 -0.433 . . . . 11.67 110.72 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 168.64 127.4 0.91 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.782 -0.723 . . . . 12.86 112.493 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -107.36 -22.54 12.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.724 0.297 . . . . 15.37 110.976 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -65.2 160.2 21.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 16.54 110.868 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 50.5 t . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.231 -0.89 . . . . 17.97 110.802 179.966 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 504' ' ' ILE . . . . . 0.648 ' H2 ' HD12 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.277 0 N-CA-C 113.094 0.776 . . . . 2.63 113.094 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 74.9 m -48.84 119.11 2.94 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.519 0.563 . . . . 1.82 112.519 174.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.79 1.5 67.86 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 120.948 -0.644 . . . . 0.0 114.501 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.4 -7.57 41.21 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 117.549 0.674 . . . . 1.02 112.444 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 24.8 mmt -112.43 159.98 18.2 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.22 0.533 . . . . 2.72 112.262 174.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -69.64 134.28 48.53 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 109.051 -0.722 . . . . 3.51 109.051 174.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.78 -35.39 0.79 Allowed 'General case' 0 C--O 1.239 0.533 0 N-CA-C 113.37 0.878 . . . . 2.66 113.37 -173.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -73.82 -41.88 61.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.531 -0.759 . . . . 2.44 112.1 -176.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -64.85 -40.18 94.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.182 0.515 . . . . 2.08 110.873 171.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -53.7 -48.61 69.38 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.285 -0.87 . . . . 1.92 111.107 177.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 514' ' ' LYS . . . . . 0.603 ' HB3' ' HZ2' ' B' ' 514' ' ' LYS . 9.9 mtpm? -54.86 -57.67 10.66 Favored 'General case' 0 C--O 1.241 0.65 0 N-CA-C 111.889 0.329 . . . . 3.15 111.889 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -56.63 -35.85 68.81 Favored 'General case' 0 CA--C 1.504 -0.817 0 O-C-N 124.129 0.893 . . . . 4.26 111.138 -177.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -76.15 -45.63 32.62 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.151 -0.932 . . . . 2.37 110.515 -173.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 517' ' ' LEU . . . . . 0.518 ' HA ' HG13 ' B' ' 520' ' ' VAL . 8.2 tt -66.68 -32.26 73.46 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.761 -0.654 . . . . 2.46 112.64 177.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 518' ' ' VAL . . . . . . . . . . . . . 44.6 t -67.47 -35.1 72.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 118.515 -1.274 . . . . 2.02 109.081 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 75.9 p -72.93 -36.42 67.22 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.451 0.643 . . . . 1.82 112.42 178.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 520' ' ' VAL . . . . . 0.518 HG13 ' HA ' ' B' ' 517' ' ' LEU . 9.8 p -71.18 -42.36 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 O-C-N 122.094 -0.379 . . . . 1.86 111.673 -174.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 521' ' ' ILE . . . . . 0.483 HG12 ' O ' ' B' ' 517' ' ' LEU . 26.2 pt -90.64 -25.8 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.442 1.645 . . . . 2.46 115.442 -175.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -60.82 -35.21 75.95 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.657 -0.868 . . . . 2.99 108.657 173.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -92.43 -21.46 20.18 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.987 1.477 . . . . 2.17 114.987 -177.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 84.3 mt -70.6 -45.46 65.27 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 109.275 -0.639 . . . . 2.08 109.275 169.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . 0.57 HD22 HD11 ' B' ' 544' ' ' ILE . 3.7 mm? -52.16 -45.46 65.08 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.28 0.562 . . . . 2.48 110.97 169.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.5 -40.59 94.34 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 -178.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -63.57 -36.12 82.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 2.2 111.47 175.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 44.1 t -63.55 -47.6 80.9 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.041 -0.527 . . . . 1.05 110.709 -175.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -61.78 -29.57 70.23 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.518 -0.764 . . . . 2.5 112.585 173.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -71.64 -54.76 9.35 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.358 0.873 . . . . 2.83 113.358 -177.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -68.77 137.97 54.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.97 -0.559 . . . . 2.73 111.002 -177.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 532' ' ' ARG . . . . . 0.425 ' HG2' ' N ' ' B' ' 533' ' ' GLY . 52.6 ttt180 -96.43 160.74 14.25 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.773 -0.649 . . . . 4.81 110.208 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 533' ' ' GLY . . . . . 0.425 ' N ' ' HG2' ' B' ' 532' ' ' ARG . . . 87.46 119.63 1.36 Allowed Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 115.982 -0.554 . . . . 0.0 113.954 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 534' ' ' LYS . . . . . 0.664 ' HD3' ' H ' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.04 -36.72 8.31 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.172 0.804 . . . . 3.36 113.172 177.234 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -50.61 -51.8 45.33 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.868 -0.52 . . . . 2.2 110.809 174.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 536' ' ' ASN . . . . . 0.45 ' O ' HG23 ' B' ' 539' ' ' ILE . 40.0 m-80 -66.13 -44.77 83.26 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.603 0.594 . . . . 2.09 112.603 178.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 537' ' ' LYS . . . . . 0.534 ' HA ' HG22 ' B' ' 540' ' ' ILE . 96.8 mttt -67.88 -31.95 72.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.427 -0.509 . . . . 2.93 110.331 -174.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.08 -46.97 69.53 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.822 -0.626 . . . . 1.02 111.149 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 539' ' ' ILE . . . . . 0.536 HG22 ' N ' ' B' ' 540' ' ' ILE . 10.2 tp -58.1 -54.99 24.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 121.542 0.687 . . . . 2.34 111.26 173.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 540' ' ' ILE . . . . . 0.536 ' N ' HG22 ' B' ' 539' ' ' ILE . 10.0 tp -56.83 -48.07 81.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 121.672 -0.642 . . . . 2.37 110.581 -178.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 541' ' ' ALA . . . . . 0.41 ' N ' HG21 ' B' ' 540' ' ' ILE . . . -57.55 -44.03 84.9 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 113.545 0.943 . . . . 0.69 113.545 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 542' ' ' SER . . . . . 0.513 ' HB2' ' HE1' ' B' ' 583' ' ' MET . 96.0 p -60.47 -38.72 85.14 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.625 -0.43 . . . . 1.63 110.297 -178.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 543' ' ' ASN . . . . . 0.43 ' O ' HG12 ' B' ' 547' ' ' ILE . 27.4 t-20 -69.08 -47.08 66.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 114.339 1.237 . . . . 2.41 114.339 -175.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 544' ' ' ILE . . . . . 0.57 HD11 HD22 ' B' ' 525' ' ' LEU . 45.2 mt -52.71 -45.88 49.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.479 -0.934 . . . . 2.23 108.479 170.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 545' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -64.02 -42.32 97.14 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.778 -0.769 . . . . 3.06 112.766 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -58.33 -48.81 79.34 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 119.234 -0.986 . . . . 2.36 109.845 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 547' ' ' ILE . . . . . 0.43 HG12 ' O ' ' B' ' 543' ' ' ASN . 44.8 mm -55.06 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.77 0.656 . . . . 2.07 112.77 179.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 548' ' ' VAL . . . . . 0.496 HG11 HD13 ' B' ' 555' ' ' LEU . 86.4 t -47.37 -44.22 8.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 C-N-CA 119.837 -0.745 . . . . 2.03 111.454 176.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.41 -28.08 58.9 Favored Glycine 0 C--O 1.237 0.319 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -87.06 -9.48 55.35 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.571 0.582 . . . . 2.85 112.571 -175.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -120.4 59.64 7.0 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 113.79 1.033 . . . . 3.84 113.79 -176.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -56.04 -39.3 92.05 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 O-C-N 122.189 0.573 . . . . 0.89 113.132 178.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -56.39 -46.66 80.01 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 121.074 0.464 . . . . 4.49 109.924 -174.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -48.9 -59.75 3.33 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 123.896 0.879 . . . . 1.05 112.125 167.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 555' ' ' LEU . . . . . 0.541 ' HB3' HD13 ' B' ' 562' ' ' LEU . 83.8 mt -54.38 -48.58 71.36 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.304 -0.407 . . . . 2.09 110.158 -178.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . 0.449 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 76.8 ttt180 -53.83 -35.91 61.97 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 113.814 1.042 . . . . 3.63 113.814 -178.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.09 -12.13 50.91 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.486 -0.486 . . . . 1.0 112.08 -177.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 558' ' ' HIS . . . . . 0.54 ' HE2' ' HE2' ' B' ' 514' ' ' LYS . 94.7 m-70 -128.28 78.48 1.84 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.405 1.261 . . . . 3.8 114.405 -177.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 559' ' ' TRP . . . . . 0.546 ' HB2' HE21 ' B' ' 603' ' ' GLN . 38.8 p90 -50.55 -48.25 57.48 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.505 2.039 . . . . 3.87 116.505 -176.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 560' ' ' LYS . . . . . 0.599 ' HZ3' ' HB2' ' B' ' 560' ' ' LYS . 0.1 OUTLIER -56.66 -36.62 69.76 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.378 -0.374 . . . . 3.79 111.132 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 561' ' ' PHE . . . . . 0.467 ' O ' HG23 ' B' ' 565' ' ' VAL . 0.6 OUTLIER -74.9 -45.13 44.83 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 119.16 -1.016 . . . . 1.8 111.952 175.575 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . 0.541 HD13 ' HB3' ' B' ' 555' ' ' LEU . 58.5 tp -49.94 -59.22 4.07 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 122.428 0.291 . . . . 1.94 110.264 174.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 563' ' ' LYS . . . . . 0.612 ' HZ2' ' HB2' ' B' ' 563' ' ' LYS . 10.2 mtmp? -50.11 -38.73 40.23 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.835 1.05 . . . . 3.16 113.835 178.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 87.4 m -71.75 -39.35 70.09 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.553 0.692 . . . . 1.88 110.429 -176.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 565' ' ' VAL . . . . . 0.467 HG23 ' O ' ' B' ' 561' ' ' PHE . 67.2 t -62.92 -41.15 91.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.618 -0.719 . . . . 1.81 112.551 173.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 566' ' ' VAL . . . . . 0.423 HG13 ' CE2' ' B' ' 570' ' ' PHE . 43.1 t -71.08 -50.89 39.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 120.546 -0.462 . . . . 2.0 110.819 -176.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -51.1 -37.39 45.58 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.951 -0.568 . . . . 2.53 112.029 170.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 568' ' ' LYS . . . . . 0.507 ' HD3' HD22 ' A' ' 14' ' ' LEU . 33.1 ttpt -72.6 -32.77 66.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.67 -0.493 . . . . 3.93 109.67 -179.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 569' ' ' LEU . . . . . 0.62 HD13 ' HB1' ' B' ' 584' ' ' ALA . 1.8 tm? -67.44 -36.46 81.26 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.739 -0.837 . . . . 2.53 108.739 177.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 570' ' ' PHE . . . . . 0.46 ' HD1' ' HE3' ' B' ' 573' ' ' MET . 24.6 m-85 -65.41 -39.31 92.0 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.863 -0.421 . . . . 4.72 109.863 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -57.67 -53.56 56.78 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 119.908 -0.717 . . . . 2.47 110.479 176.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -62.36 -10.03 10.02 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.108 1.151 . . . . 1.87 114.108 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 573' ' ' MET . . . . . 0.648 ' HB3' HD11 ' B' ' 625' ' ' LEU . 18.0 mtm -76.35 -5.34 46.74 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.616 0.722 . . . . 2.56 109.641 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 29.6 m-70 -109.42 -0.61 18.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.815 -1.084 . . . . 4.11 111.452 173.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 575' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -68.51 130.2 42.18 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.212 -0.449 . . . . 1.57 110.083 177.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 7.9 t -87.81 -21.32 25.14 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.027 0.751 . . . . 2.01 113.027 -177.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -60.19 128.02 34.71 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.409 0.623 . . . . 3.71 112.532 -175.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -44.89 125.91 5.4 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.315 -0.857 . . . . 2.15 113.011 -171.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.76 4.74 Favored Glycine 0 C--O 1.222 -0.643 0 N-CA-C 116.323 1.289 . . . . 0.0 116.323 174.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 45.2 t -53.72 -46.37 62.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 113.186 0.81 . . . . 1.89 113.186 -175.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.551 ' HB2' HE22 ' B' ' 629' ' ' GLN . 3.3 pt20 -59.63 -42.31 92.43 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.384 0.513 . . . . 2.46 112.384 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -60.46 -42.45 96.22 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.168 0.433 . . . . 2.23 112.168 172.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 583' ' ' MET . . . . . 0.513 ' HE1' ' HB2' ' B' ' 542' ' ' SER . 37.1 tpp -60.74 -49.42 77.59 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 121.027 -0.269 . . . . 3.01 110.431 175.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 584' ' ' ALA . . . . . 0.62 ' HB1' HD13 ' B' ' 569' ' ' LEU . . . -56.85 -42.96 80.65 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.162 -0.472 . . . . 1.01 111.692 -177.159 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 52.6 t -74.36 -40.93 61.8 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 120.041 -0.664 . . . . 2.2 111.943 -177.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 586' ' ' ASP . . . . . 0.447 ' O ' HG23 ' B' ' 589' ' ' ILE . 15.5 t70 -59.7 -46.26 89.63 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.312 -0.404 . . . . 1.98 111.935 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 46.8 m -62.15 -41.23 98.09 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.433 0.693 . . . . 1.92 110.39 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 588' ' ' PHE . . . . . 0.586 ' HB2' HD12 ' B' ' 569' ' ' LEU . 87.8 t80 -61.5 -32.17 72.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.075 -0.511 . . . . 0.72 111.142 -177.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 589' ' ' ILE . . . . . 0.447 HG23 ' O ' ' B' ' 586' ' ' ASP . 8.9 tp -79.95 -35.91 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.847 -1.941 . . . . 2.46 109.854 -175.42 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . 0.619 ' HZ3' ' HB3' ' B' ' 590' ' ' LYS . 3.7 mmmp? -57.46 -49.99 74.49 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 107.747 -1.205 . . . . 3.09 107.747 176.025 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 87.8 mt -63.83 -43.76 97.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.725 -0.671 . . . . 2.43 112.739 -176.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.14 93.45 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.512 -0.475 . . . . 1.01 112.244 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -62.26 -70.19 0.21 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.222 -0.991 . . . . 2.88 109.796 174.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -56.1 -23.86 36.72 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.562 2.06 . . . . 2.67 116.562 -176.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 75.0 m -121.68 25.24 9.38 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.261 1.208 . . . . 1.97 114.261 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -48.48 -38.54 20.32 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.861 1.8 . . . . 4.07 115.861 -172.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -69.56 -32.66 71.57 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.186 0.809 . . . . 4.32 113.186 -175.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 598' ' ' HIS . . . . . 0.449 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 55.1 m-70 -70.12 -3.85 18.6 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.617 -0.72 . . . . 2.88 112.072 -173.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -105.58 -16.93 14.57 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.585 0.553 . . . . 3.7 110.228 -176.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 46.5 t -105.82 -24.39 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.017 -0.992 . . . . 2.05 111.295 -175.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -101.99 139.5 37.54 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.547 -0.861 . . . . 2.81 111.599 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 4.3 p -60.91 122.7 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 N-CA-C 108.599 -0.889 . . . . 1.99 108.599 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 603' ' ' GLN . . . . . 0.546 HE21 ' HB2' ' B' ' 559' ' ' TRP . 5.1 mt-30 -92.68 167.3 11.99 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.706 0.629 . . . . 3.39 110.138 -177.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.01 129.08 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 C-N-CA 119.881 -0.728 . . . . 1.91 112.907 -175.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.26 6.58 64.55 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.069 -175.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 606' ' ' GLU . . . . . 0.522 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.1 tp10 -131.46 158.03 41.92 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.611 -0.836 . . . . 2.51 110.78 175.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 33.3 m -103.24 -22.58 4.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.13 -0.941 . . . . 2.03 112.582 -175.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 608' ' ' MET . . . . . 0.522 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 23.2 ptt? -136.92 142.25 37.89 Favored Pre-proline 0 C--O 1.223 -0.297 0 N-CA-C 112.611 0.597 . . . . 3.15 112.611 -174.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.08 130.89 36.92 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.85 112.131 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -57.01 -31.87 65.55 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.792 0.293 . . . . 3.05 111.792 -174.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 611' ' ' ILE . . . . . . . . . . . . . 11.8 tt -50.05 -44.8 22.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.85 0.357 . . . . 2.38 110.56 178.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -49.92 -52.01 36.57 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.623 0.769 . . . . 2.15 112.906 177.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -59.84 -37.17 78.47 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 120.604 -0.438 . . . . 2.66 110.223 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 31.9 mm -64.55 -47.98 86.87 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.181 -0.607 . . . . 2.28 111.922 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 8.4 tt -62.63 -31.11 71.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.98 0.733 . . . . 2.38 112.98 -177.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -79.57 2.15 23.36 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.61 1.337 . . . . 2.62 114.61 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -142.41 15.66 2.02 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 113.103 0.779 . . . . 2.63 113.103 -174.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 618' ' ' ILE . . . . . 0.504 HG12 ' N ' ' B' ' 619' ' ' ASN . 0.2 OUTLIER -47.0 -46.98 8.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 C-N-CA 118.957 -1.097 . . . . 2.47 110.183 -176.663 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 619' ' ' ASN . . . . . 0.504 ' N ' HG12 ' B' ' 618' ' ' ILE . 6.0 p30 -63.19 -51.11 67.65 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.759 1.022 . . . . 2.98 113.759 -176.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 76.3 p -56.85 -31.88 65.23 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 119.449 -0.9 . . . . 1.94 110.804 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 621' ' ' ILE . . . . . 0.55 HG13 HG12 ' B' ' 622' ' ' ILE . 42.0 pt -79.35 -42.62 23.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.322 1.601 . . . . 2.57 115.322 -179.003 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 622' ' ' ILE . . . . . 0.55 HG12 HG13 ' B' ' 621' ' ' ILE . 19.7 mm -87.72 -6.26 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 115.035 1.494 . . . . 2.61 115.035 -177.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.6 t -19.98 -58.29 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.567 2.062 . . . . 2.06 116.567 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -99.27 -7.58 26.18 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.063 -1.426 . . . . 2.07 111.022 -163.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 625' ' ' LEU . . . . . 0.648 HD11 ' HB3' ' B' ' 573' ' ' MET . 8.3 mp -71.83 146.82 47.74 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.409 -0.36 . . . . 2.24 111.7 -173.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 626' ' ' GLN . . . . . 0.472 ' O ' HG11 ' B' ' 630' ' ' VAL . 18.9 pt20 -76.65 162.13 71.68 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 108.814 -0.81 . . . . 2.99 108.814 174.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 627' ' ' PRO . . . . . 0.545 ' O ' HG22 ' B' ' 630' ' ' VAL . 79.4 Cg_exo -47.96 -43.51 29.86 Favored 'Trans proline' 0 C--O 1.233 0.263 0 N-CA-C 115.827 1.434 . . . . 0.86 115.827 -178.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 628' ' ' GLN . . . . . 0.448 ' NE2' ' HB2' ' B' ' 627' ' ' PRO . 2.0 mp0 -67.33 -43.01 82.65 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.602 -0.518 . . . . 3.24 109.602 -174.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 629' ' ' GLN . . . . . 0.551 HE22 ' HB2' ' B' ' 581' ' ' GLN . 28.9 mt-30 -63.23 -38.34 90.8 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.944 -0.571 . . . . 2.79 110.928 178.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 630' ' ' VAL . . . . . 0.545 HG22 ' O ' ' B' ' 627' ' ' PRO . 1.0 OUTLIER . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.213 -0.898 . . . . 1.93 110.669 176.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.202 0 N-CA-C 112.377 -0.289 . . . . 10.09 112.377 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.4 m -111.09 85.0 2.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.799 0.333 . . . . 8.94 110.77 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -153.97 73.88 0.96 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.077 -0.51 . . . . 7.08 111.009 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 77.4 p -118.79 -58.38 1.96 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.133 -0.485 . . . . 6.5 110.987 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -94.34 123.75 7.63 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.741 -0.742 . . . . 4.42 112.512 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -164.48 -30.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.789 0.328 . . . . 4.56 110.874 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.7 mp -80.41 -9.57 59.75 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.36 -0.382 . . . . 2.59 111.077 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -56.57 -31.62 64.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.227 -0.442 . . . . 4.13 111.457 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -79.37 -22.76 43.94 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.769 0.319 . . . . 4.17 111.252 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.5 mt -66.08 -10.84 44.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.392 -0.367 . . . . 3.01 111.062 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.79 -45.14 25.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 3.23 111.38 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 69.2 mt -61.98 -14.36 34.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.321 -0.4 . . . . 4.01 111.243 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.43 ' HE3' ' HG3' ' B' ' 522' ' ' LYS . 24.8 ttmm -79.78 -37.91 34.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 5.26 111.097 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.517 HD21 ' HB ' ' B' ' 564' ' ' THR . 69.5 tp -60.92 -17.86 53.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.388 -0.369 . . . . 3.63 110.995 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.24 -27.61 35.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.324 -0.398 . . . . 3.49 110.997 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -92.94 90.48 1.44 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.786 -0.721 . . . . 3.04 112.307 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.403 ' HG ' ' HZ ' ' B' ' 572' ' ' PHE . 40.3 tp -165.73 87.79 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.06 0.457 . . . . 2.53 110.842 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -137.31 131.08 31.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.927 -0.579 . . . . 3.92 110.731 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.466 HG21 ' HB2' ' B' ' 537' ' ' LYS . 73.7 mt -83.33 -30.21 8.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.493 . . . . 3.25 111.139 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -79.84 -20.64 45.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.263 -0.426 . . . . 6.51 111.571 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.654 ' HZ1' ' HB3' ' A' ' 21' ' ' LYS . 6.3 ttpm? -63.22 126.8 28.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.686 0.279 . . . . 9.65 110.943 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.2 t -156.63 -29.66 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.147 -0.479 . . . . 9.14 110.849 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -117.89 130.6 56.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.96 -0.563 . . . . 11.67 110.74 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 118.57 115.85 2.66 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.781 -0.723 . . . . 12.86 112.479 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -84.58 122.05 28.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.727 0.298 . . . . 15.37 110.907 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -140.88 -39.29 0.42 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 16.54 110.846 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 52.1 t . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.289 -0.862 . . . . 17.97 111.002 -179.95 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 504' ' ' ILE . . . . . 0.663 HG13 ' HB1' ' B' ' 507' ' ' ALA . 8.0 tp . . . . . 0 C--O 1.236 0.342 0 N-CA-C 112.985 0.735 . . . . 2.63 112.985 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 505' ' ' SER . . . . . 0.44 ' HB3' ' HG2' ' B' ' 550' ' ' GLN . 79.5 p -48.9 119.16 3.0 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.553 0.575 . . . . 1.82 112.553 174.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.86 1.38 67.78 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.92 -0.657 . . . . 0.0 114.407 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 507' ' ' ALA . . . . . 0.663 ' HB1' HG13 ' B' ' 504' ' ' ILE . . . -94.26 -7.6 41.55 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 117.677 0.738 . . . . 1.02 112.48 176.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 26.4 mmt -112.47 159.93 18.27 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.107 -0.497 . . . . 2.72 112.269 174.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -69.7 134.24 48.43 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 109.14 -0.689 . . . . 3.51 109.14 174.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 510' ' ' GLU . . . . . 0.479 ' HG2' ' HE2' ' B' ' 514' ' ' LYS . 40.6 tt0 -41.65 -35.43 0.76 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 113.375 0.88 . . . . 2.66 113.375 -173.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.73 -42.03 61.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.621 -0.718 . . . . 2.44 112.118 -176.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -64.84 -40.1 94.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.129 0.49 . . . . 2.08 110.855 171.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -53.72 -48.65 69.39 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.369 -0.832 . . . . 1.92 111.183 177.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 514' ' ' LYS . . . . . 0.479 ' HE2' ' HG2' ' B' ' 510' ' ' GLU . 66.3 mttm -54.84 -57.56 11.1 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 111.93 0.345 . . . . 3.15 111.93 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -56.66 -35.84 68.86 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 124.157 0.911 . . . . 4.26 111.116 -177.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -76.26 -45.51 32.35 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.121 -0.945 . . . . 2.37 110.502 -173.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 517' ' ' LEU . . . . . 0.485 ' O ' HG12 ' B' ' 520' ' ' VAL . 91.0 mt -66.77 -32.25 73.41 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.757 -0.656 . . . . 2.46 112.596 177.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 518' ' ' VAL . . . . . 0.443 HG21 ' O ' ' B' ' 514' ' ' LYS . 78.5 t -67.45 -35.15 72.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 118.495 -1.282 . . . . 2.02 109.021 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 41.4 p -72.98 -36.26 67.04 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.311 0.577 . . . . 1.82 112.401 178.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 520' ' ' VAL . . . . . 0.485 HG12 ' O ' ' B' ' 517' ' ' LEU . 9.3 p -71.3 -42.37 74.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 116.48 -0.327 . . . . 1.86 111.588 -174.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 521' ' ' ILE . . . . . 0.455 HG22 HG11 ' B' ' 520' ' ' VAL . 15.5 pt -90.57 -25.82 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 115.455 1.65 . . . . 2.46 115.455 -175.135 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 522' ' ' LYS . . . . . 0.43 ' HG3' ' HE3' ' A' ' 13' ' ' LYS . 34.1 ttmt -60.89 -35.16 75.91 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.682 -0.858 . . . . 2.99 108.682 173.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -92.45 -21.49 20.15 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 114.988 1.477 . . . . 2.17 114.988 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 77.5 mt -70.6 -45.36 65.44 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.295 -0.631 . . . . 2.08 109.295 168.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 83.9 mt -52.3 -45.45 65.54 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.222 0.534 . . . . 2.48 110.942 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.5 -40.54 94.34 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 73.4 mt -63.52 -36.18 82.94 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.033 0.444 . . . . 2.2 111.437 175.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 42.3 t -63.47 -47.83 80.19 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.082 -0.508 . . . . 1.05 110.63 -175.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.64 -29.6 70.16 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.438 -0.801 . . . . 2.5 112.616 173.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -71.72 -54.65 9.59 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.341 0.867 . . . . 2.83 113.341 -177.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 17.1 tptp -68.76 137.95 54.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.008 -0.542 . . . . 2.73 111.031 -177.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 532' ' ' ARG . . . . . 0.439 ' HA ' ' HZ3' ' B' ' 537' ' ' LYS . 16.3 ptp180 -96.43 160.72 14.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.765 -0.652 . . . . 4.81 110.19 178.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.39 119.58 1.34 Allowed Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.918 -0.583 . . . . 0.0 114.018 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -46.99 -36.71 8.07 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.187 0.81 . . . . 3.36 113.187 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -50.53 -51.86 43.95 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 120.337 -0.545 . . . . 2.2 110.799 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 -66.09 -44.82 83.3 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.621 0.601 . . . . 2.09 112.621 178.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 537' ' ' LYS . . . . . 0.466 ' HB2' HG21 ' A' ' 19' ' ' ILE . 63.1 mttp -67.8 -32.08 72.39 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.468 -0.493 . . . . 2.93 110.258 -174.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.1 -46.93 69.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.835 -0.62 . . . . 1.02 111.117 178.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 45.4 mm -58.15 -54.97 25.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 121.622 0.725 . . . . 2.34 111.315 173.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 540' ' ' ILE . . . . . . . . . . . . . 82.8 mt -56.73 -48.19 81.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.663 -0.648 . . . . 2.37 110.592 -178.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.43 -44.05 84.35 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.577 0.954 . . . . 0.69 113.577 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 542' ' ' SER . . . . . 0.506 ' HB2' ' HE2' ' B' ' 583' ' ' MET . 88.9 p -60.5 -38.78 85.43 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.571 -0.451 . . . . 1.63 110.297 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -68.96 -47.09 66.5 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.407 1.262 . . . . 2.41 114.407 -175.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 544' ' ' ILE . . . . . 0.49 ' HA ' HG12 ' B' ' 547' ' ' ILE . 61.2 mt -52.67 -45.89 49.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.539 -0.912 . . . . 2.23 108.539 170.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 545' ' ' MET . . . . . 0.701 ' HB3' HG22 ' B' ' 587' ' ' THR . 0.2 OUTLIER -64.08 -42.31 97.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.693 -0.803 . . . . 3.06 112.825 179.389 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -58.19 -48.84 79.06 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 119.197 -1.001 . . . . 2.36 109.962 176.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 547' ' ' ILE . . . . . 0.49 HG12 ' HA ' ' B' ' 544' ' ' ILE . 38.1 pt -55.02 -61.43 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.856 0.687 . . . . 2.07 112.856 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 548' ' ' VAL . . . . . 0.442 ' H ' HG13 ' B' ' 547' ' ' ILE . 10.2 p -47.3 -44.26 8.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 C-N-CA 119.784 -0.767 . . . . 2.03 111.446 176.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.37 -28.07 58.8 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.823 -0.548 . . . . 0.0 112.976 -177.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 550' ' ' GLN . . . . . 0.44 ' HG2' ' HB3' ' B' ' 505' ' ' SER . 47.3 tt0 -87.01 -9.55 55.27 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 112.601 0.593 . . . . 2.85 112.601 -175.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -120.48 59.72 7.2 Favored Pre-proline 0 CA--C 1.536 0.44 0 N-CA-C 113.792 1.034 . . . . 3.84 113.792 -176.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -55.97 -39.34 91.78 Favored 'Trans proline' 0 C--O 1.222 -0.311 0 O-C-N 122.122 0.538 . . . . 0.89 113.246 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 17.0 tpp180 -56.35 -46.66 79.88 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 121.022 0.439 . . . . 4.49 109.88 -174.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -49.0 -59.69 3.4 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 123.967 0.907 . . . . 1.05 112.098 168.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 555' ' ' LEU . . . . . . . . . . . . . 4.7 tp -54.33 -48.64 71.15 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 116.272 -0.422 . . . . 2.09 110.219 -179.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . 0.571 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 64.9 ttt180 -53.84 -35.93 62.01 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 113.739 1.015 . . . . 3.63 113.739 -178.228 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.06 -12.16 50.89 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.486 -0.486 . . . . 1.0 112.047 -177.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 558' ' ' HIS . . . . . 0.402 ' HE2' ' HZ1' ' B' ' 514' ' ' LYS . 94.2 m-70 -128.24 78.56 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 3.8 114.388 -177.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.57 -48.25 57.59 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.55 2.055 . . . . 3.87 116.55 -176.041 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 560' ' ' LYS . . . . . 0.414 ' HZ3' ' HA3' ' B' ' 605' ' ' GLY . 75.6 mmtt -56.68 -36.65 69.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 3.79 111.121 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 561' ' ' PHE . . . . . 0.41 ' O ' HG22 ' B' ' 565' ' ' VAL . 1.2 t80 -74.82 -45.09 45.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.142 -1.023 . . . . 1.8 112.009 175.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . 0.453 HD23 ' HE1' ' B' ' 599' ' ' PHE . 9.6 tt -50.07 -59.04 4.29 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.597 -0.274 . . . . 1.94 110.306 175.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -50.26 -38.62 41.78 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.805 1.039 . . . . 3.16 113.805 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 564' ' ' THR . . . . . 0.517 ' HB ' HD21 ' A' ' 14' ' ' LEU . 26.1 p -71.76 -39.43 70.01 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.534 0.683 . . . . 1.88 110.38 -176.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 565' ' ' VAL . . . . . 0.43 ' O ' ' HG ' ' B' ' 569' ' ' LEU . 95.7 t -62.8 -41.37 92.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.577 -0.738 . . . . 1.81 112.511 173.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 566' ' ' VAL . . . . . 0.566 HG21 HD13 ' B' ' 591' ' ' ILE . 46.3 t -70.99 -50.87 39.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 120.621 -0.432 . . . . 2.0 110.795 -176.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -51.11 -37.43 45.93 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.075 -0.511 . . . . 2.53 111.987 170.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -72.67 -32.63 65.96 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.733 -0.469 . . . . 3.93 109.733 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 569' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' B' ' 565' ' ' VAL . 54.1 mt -67.51 -36.47 81.11 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 108.703 -0.851 . . . . 2.53 108.703 177.072 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 570' ' ' PHE . . . . . 0.454 ' HD1' HG23 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.39 -39.43 92.21 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.851 -0.425 . . . . 4.72 109.851 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -57.52 -53.64 55.89 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 119.97 -0.692 . . . . 2.47 110.52 176.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 572' ' ' PHE . . . . . 0.403 ' HZ ' ' HG ' ' A' ' 17' ' ' LEU . 3.1 m-85 -62.36 -9.99 9.9 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 114.092 1.145 . . . . 1.87 114.092 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 573' ' ' MET . . . . . 0.628 ' HB3' HD22 ' B' ' 625' ' ' LEU . 89.5 mtp -76.35 -5.37 46.84 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.614 0.721 . . . . 2.56 109.641 178.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 60.6 m80 -109.39 -0.59 18.92 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.78 -1.1 . . . . 4.11 111.465 173.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 575' ' ' GLU . . . . . 0.6 ' HB3' HG12 ' B' ' 580' ' ' VAL . 8.1 tp10 -68.46 130.18 42.11 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.193 -0.458 . . . . 1.57 110.162 177.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 72.4 p -87.84 -21.35 25.08 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 112.991 0.737 . . . . 2.01 112.991 -177.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -60.2 128.03 34.76 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.364 0.602 . . . . 3.71 112.596 -175.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -44.9 125.88 5.4 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.388 -0.824 . . . . 2.15 113.103 -171.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.19 -34.65 4.81 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 116.207 1.243 . . . . 0.0 116.207 174.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 580' ' ' VAL . . . . . 0.6 HG12 ' HB3' ' B' ' 575' ' ' GLU . 13.4 p -53.75 -46.34 62.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.154 0.798 . . . . 1.89 113.154 -175.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -59.67 -42.29 92.56 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.365 0.506 . . . . 2.46 112.365 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -60.56 -42.36 96.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 112.243 0.461 . . . . 2.23 112.243 172.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 583' ' ' MET . . . . . 0.506 ' HE2' ' HB2' ' B' ' 542' ' ' SER . 40.0 tpp -60.71 -49.45 77.47 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 121.126 -0.229 . . . . 3.01 110.432 175.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.83 -43.06 80.68 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.196 -0.456 . . . . 1.01 111.634 -177.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 52.2 t -74.32 -40.92 61.9 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 119.997 -0.681 . . . . 2.2 112.025 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -59.55 -46.41 88.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.415 . . . . 1.98 111.886 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 587' ' ' THR . . . . . 0.701 HG22 ' HB3' ' B' ' 545' ' ' MET . 81.4 p -62.16 -41.22 98.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.92 110.43 175.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 588' ' ' PHE . . . . . 0.532 ' HA ' HG12 ' B' ' 591' ' ' ILE . 88.7 t80 -61.5 -32.09 72.11 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.085 -0.507 . . . . 0.72 111.189 -177.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 589' ' ' ILE . . . . . . . . . . . . . 48.5 mm -79.99 -35.87 16.4 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.89 -1.924 . . . . 2.46 109.806 -175.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -57.56 -50.01 74.5 Favored 'General case' 0 C--O 1.221 -0.438 0 N-CA-C 107.756 -1.201 . . . . 3.09 107.756 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . 0.566 HD13 HG21 ' B' ' 566' ' ' VAL . 37.1 pt -63.74 -43.72 98.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.688 -0.687 . . . . 2.43 112.802 -177.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . 0.471 ' N ' HG13 ' B' ' 591' ' ' ILE . . . -63.96 -39.13 93.43 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.494 -0.482 . . . . 1.01 112.261 177.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -62.41 -70.02 0.22 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 119.096 -1.041 . . . . 2.88 109.807 174.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -56.12 -23.82 36.72 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 116.587 2.069 . . . . 2.67 116.587 -176.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 595' ' ' CYS . . . . . 0.406 ' SG ' ' O ' ' B' ' 591' ' ' ILE . 1.3 p -121.61 25.14 9.47 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 114.247 1.203 . . . . 1.97 114.247 -178.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 596' ' ' ARG . . . . . 0.428 ' HA ' ' HE ' ' B' ' 596' ' ' ARG . 0.0 OUTLIER -48.5 -38.6 20.57 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.824 1.787 . . . . 4.07 115.824 -172.404 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -69.48 -32.62 71.62 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.214 0.82 . . . . 4.32 113.214 -175.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 598' ' ' HIS . . . . . 0.571 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 57.5 m-70 -70.15 -3.9 18.93 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.619 -0.719 . . . . 2.88 112.05 -173.558 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 599' ' ' PHE . . . . . 0.453 ' HE1' HD23 ' B' ' 562' ' ' LEU . 6.1 m-85 -105.51 -16.96 14.57 Favored 'General case' 0 CA--C 1.516 -0.329 0 O-C-N 123.669 0.606 . . . . 3.7 110.268 -176.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 9.3 p -105.84 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.039 -0.982 . . . . 2.05 111.325 -175.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -101.95 139.53 37.46 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.547 -0.861 . . . . 2.81 111.601 176.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 5.7 p -60.91 122.76 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.489 0 N-CA-C 108.577 -0.898 . . . . 1.99 108.577 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -92.83 167.34 11.91 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 123.705 0.628 . . . . 3.39 110.051 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 17.3 m -71.93 128.96 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 N-CA-C 112.981 0.734 . . . . 1.91 112.981 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 605' ' ' GLY . . . . . 0.414 ' HA3' ' HZ3' ' B' ' 560' ' ' LYS . . . 92.38 6.51 64.4 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.082 -175.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -131.55 158.04 42.0 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.555 -0.858 . . . . 2.51 110.766 175.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 31.5 m -103.24 -22.56 4.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.093 -0.958 . . . . 2.03 112.507 -175.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 608' ' ' MET . . . . . 0.415 ' HG3' ' HD2' ' B' ' 609' ' ' PRO . 59.6 ttp -136.99 142.26 37.79 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.643 0.609 . . . . 3.15 112.643 -174.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 609' ' ' PRO . . . . . 0.415 ' HD2' ' HG3' ' B' ' 608' ' ' MET . 68.9 Cg_exo -52.09 130.92 37.03 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.928 1.085 . . . . 0.85 112.094 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -57.01 -31.86 65.54 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.792 0.293 . . . . 3.05 111.792 -174.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 611' ' ' ILE . . . . . . . . . . . . . 14.0 tt -50.06 -44.75 22.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.814 0.34 . . . . 2.38 110.592 178.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -49.92 -52.11 35.7 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.632 0.773 . . . . 2.15 112.854 177.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -59.84 -37.14 78.39 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.612 -0.435 . . . . 2.66 110.21 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 41.6 mm -64.49 -48.04 86.71 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 120.169 -0.612 . . . . 2.28 111.946 178.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.57 -31.13 71.88 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.012 0.745 . . . . 2.38 113.012 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -79.55 2.1 23.46 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.569 1.322 . . . . 2.62 114.569 -179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 36.5 p30 -142.42 15.59 2.02 Favored 'General case' 0 C--O 1.242 0.685 0 N-CA-C 113.143 0.794 . . . . 2.63 113.143 -174.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 618' ' ' ILE . . . . . 0.407 HG22 ' N ' ' B' ' 619' ' ' ASN . 10.7 tt -46.9 -46.99 8.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.47 110.222 -176.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 619' ' ' ASN . . . . . 0.407 ' N ' HG22 ' B' ' 618' ' ' ILE . 45.4 t-20 -63.23 -51.06 67.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.754 1.02 . . . . 2.98 113.754 -176.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 73.3 p -56.89 -31.88 65.31 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 119.455 -0.898 . . . . 1.94 110.782 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 621' ' ' ILE . . . . . 0.454 HG23 ' HD1' ' B' ' 570' ' ' PHE . 17.7 mt -79.33 -42.64 23.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.334 1.605 . . . . 2.57 115.334 -179.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 622' ' ' ILE . . . . . 0.646 HG22 HG13 ' B' ' 630' ' ' VAL . 14.3 mt -87.69 -6.22 10.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.055 1.502 . . . . 2.61 115.055 -177.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 44.1 t -20.0 -58.34 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 116.529 2.048 . . . . 2.06 116.529 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -99.21 -7.58 26.3 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.977 -1.465 . . . . 2.07 111.027 -163.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 625' ' ' LEU . . . . . 0.628 HD22 ' HB3' ' B' ' 573' ' ' MET . 3.6 mm? -71.97 146.86 47.47 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.443 -0.344 . . . . 2.24 111.689 -173.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 626' ' ' GLN . . . . . 0.561 ' HB3' ' HD2' ' B' ' 627' ' ' PRO . 47.5 mt-30 -76.68 162.0 72.13 Favored Pre-proline 0 CA--C 1.519 -0.241 0 N-CA-C 108.834 -0.802 . . . . 2.99 108.834 174.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 627' ' ' PRO . . . . . 0.561 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 5.4 Cg_endo -47.71 -43.67 28.12 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 N-CA-C 115.825 1.433 . . . . 0.86 115.825 -178.473 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -67.31 -43.07 82.56 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.563 -0.532 . . . . 3.24 109.563 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -63.26 -38.29 90.57 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.946 -0.57 . . . . 2.79 110.926 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 630' ' ' VAL . . . . . 0.646 HG13 HG22 ' B' ' 622' ' ' ILE . 38.6 t . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.316 -0.85 . . . . 1.93 110.695 176.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 112.445 -0.262 . . . . 10.09 112.445 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.8 m 58.17 -167.82 0.14 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.812 0.339 . . . . 8.94 111.032 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.95 -170.09 2.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.233 -0.439 . . . . 7.08 111.026 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.2 t -163.94 24.42 0.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 6.5 110.625 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -98.4 17.29 58.72 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.782 -0.723 . . . . 4.42 112.45 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -143.81 -26.06 0.55 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.761 0.315 . . . . 4.56 110.947 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.434 HD13 HD12 ' A' ' 10' ' ' LEU . 20.4 tp -73.4 -16.4 61.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 2.59 110.82 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -80.69 -40.2 25.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.25 -0.432 . . . . 4.13 111.545 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.51 -50.07 71.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.418 -0.355 . . . . 4.17 111.507 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.434 HD12 HD13 ' A' ' 7' ' ' LEU . 2.1 pp -66.55 -9.9 39.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.436 -0.347 . . . . 3.01 111.349 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.27 -13.92 59.65 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.85 0.357 . . . . 3.23 111.215 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 18.5 tp -67.39 -10.28 49.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 4.01 110.947 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -77.38 -39.68 46.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.096 -0.502 . . . . 5.26 111.509 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.508 ' HA ' HD21 ' B' ' 525' ' ' LEU . 2.3 tm? -58.17 -35.27 71.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.462 -0.336 . . . . 3.63 110.826 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.92 -13.33 10.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.341 -0.39 . . . . 3.49 111.4 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -113.85 105.43 1.6 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.775 -0.726 . . . . 3.04 112.707 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 tt -166.72 118.34 0.96 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.803 0.335 . . . . 2.53 110.381 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -152.19 140.93 20.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.239 -0.437 . . . . 3.92 111.045 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.438 ' HA ' ' HB3' ' B' ' 537' ' ' LYS . 4.5 mp -91.67 -17.58 7.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.069 -0.514 . . . . 3.25 110.857 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 36.6 t30 -143.88 102.74 3.95 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.365 -0.379 . . . . 6.51 111.179 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -172.96 140.98 0.95 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.292 -0.413 . . . . 9.65 110.797 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 64.3 p -92.33 42.58 1.11 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.985 0.422 . . . . 9.14 111.176 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -103.39 103.61 13.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 11.67 110.856 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -157.04 101.0 0.2 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.919 -0.658 . . . . 12.86 112.46 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -146.26 -167.76 2.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.836 0.35 . . . . 15.37 111.208 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -63.87 122.77 17.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.267 -0.424 . . . . 16.54 110.867 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 51.7 t . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.297 -0.859 . . . . 17.97 110.91 -179.76 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 504' ' ' ILE . . . . . 0.606 HG12 ' HB1' ' B' ' 507' ' ' ALA . 14.5 tt . . . . . 0 C--O 1.236 0.371 0 N-CA-C 113.098 0.777 . . . . 2.63 113.098 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 48.1 m -48.85 119.2 3.01 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.6 0.592 . . . . 1.82 112.6 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.85 1.45 67.75 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.946 -0.645 . . . . 0.0 114.408 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 507' ' ' ALA . . . . . 0.606 ' HB1' HG12 ' B' ' 504' ' ' ILE . . . -94.34 -7.59 41.31 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.646 0.723 . . . . 1.02 112.443 176.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 25.8 mmt -112.4 160.06 18.1 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 121.116 0.484 . . . . 2.72 112.283 174.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -69.76 134.26 48.38 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.085 -0.709 . . . . 3.51 109.085 174.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 510' ' ' GLU . . . . . 0.592 ' HB2' HH21 ' B' ' 553' ' ' ARG . 39.7 tt0 -41.68 -35.47 0.78 Allowed 'General case' 0 C--O 1.24 0.598 0 N-CA-C 113.394 0.887 . . . . 2.66 113.394 -173.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -73.73 -41.94 61.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.515 -0.766 . . . . 2.44 112.117 -176.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -64.79 -40.16 94.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.178 0.513 . . . . 2.08 110.878 171.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . 0.422 ' O ' HD11 ' B' ' 517' ' ' LEU . 45.0 tt0 -53.76 -48.62 69.56 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.344 -0.843 . . . . 1.92 111.091 177.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -54.9 -57.59 11.02 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 111.911 0.337 . . . . 3.15 111.911 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -56.6 -35.89 68.77 Favored 'General case' 0 CA--C 1.506 -0.733 0 O-C-N 124.209 0.943 . . . . 4.26 111.127 -177.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.419 ' O ' HG22 ' B' ' 520' ' ' VAL . 73.8 t80 -76.11 -45.58 33.11 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.065 -0.971 . . . . 2.37 110.515 -173.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 517' ' ' LEU . . . . . 0.426 HD21 ' CG ' ' B' ' 551' ' ' TYR . 8.7 mp -66.73 -32.25 73.42 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.755 -0.657 . . . . 2.46 112.642 177.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 518' ' ' VAL . . . . . . . . . . . . . 28.3 m -67.49 -35.1 72.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 118.535 -1.266 . . . . 2.02 109.07 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 20.7 p -72.99 -36.31 67.03 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.393 0.616 . . . . 1.82 112.408 178.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 520' ' ' VAL . . . . . 0.419 HG22 ' O ' ' B' ' 516' ' ' PHE . 54.5 t -71.23 -42.29 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 122.133 -0.354 . . . . 1.86 111.703 -174.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 521' ' ' ILE . . . . . 0.449 ' O ' HD13 ' B' ' 525' ' ' LEU . 2.3 pp -90.68 -25.83 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.442 1.645 . . . . 2.46 115.442 -175.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 6.1 tmmm? -60.75 -35.24 75.89 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.712 -0.847 . . . . 2.99 108.712 173.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -92.42 -21.53 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.979 1.474 . . . . 2.17 114.979 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 38.4 mt -70.58 -45.43 65.37 Favored 'General case' 0 C--O 1.218 -0.588 0 N-CA-C 109.313 -0.625 . . . . 2.08 109.313 168.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . 0.508 HD21 ' HA ' ' A' ' 14' ' ' LEU . 7.5 mp -52.19 -45.43 65.15 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.197 0.522 . . . . 2.48 110.978 169.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . 0.425 ' O ' ' HG2' ' B' ' 529' ' ' GLU . . . -66.51 -40.63 94.33 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 -178.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 47.0 mt -63.52 -36.07 82.57 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 2.2 111.47 175.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 528' ' ' CYS . . . . . 0.45 ' HB2' HG21 ' B' ' 540' ' ' ILE . 49.5 t -63.54 -47.7 80.55 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.08 -0.509 . . . . 1.05 110.662 -175.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 529' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' B' ' 526' ' ' GLY . 13.0 pt-20 -61.8 -29.58 70.25 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.44 -0.8 . . . . 2.5 112.542 173.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -71.68 -54.64 9.67 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.376 0.88 . . . . 2.83 113.376 -177.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 531' ' ' LYS . . . . . 0.438 ' O ' ' HD2' ' B' ' 537' ' ' LYS . 67.6 mttm -68.8 137.95 54.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.964 -0.562 . . . . 2.73 111.119 -177.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -96.46 160.7 14.27 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.811 -0.631 . . . . 4.81 110.231 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.5 119.57 1.36 Allowed Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 115.905 -0.589 . . . . 0.0 114.019 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 534' ' ' LYS . . . . . 0.456 ' HD3' ' N ' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.11 -36.65 8.61 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.176 0.806 . . . . 3.36 113.176 177.274 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -50.51 -51.92 43.22 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.382 -0.527 . . . . 2.2 110.828 174.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -65.98 -44.85 83.66 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.697 0.628 . . . . 2.09 112.697 178.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 537' ' ' LYS . . . . . 0.438 ' HB3' ' HA ' ' A' ' 19' ' ' ILE . 0.0 OUTLIER -67.78 -31.97 72.23 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.375 -0.53 . . . . 2.93 110.368 -174.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.2 -46.95 69.21 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.79 -0.641 . . . . 1.02 111.079 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 85.9 mt -58.1 -54.98 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.558 0.694 . . . . 2.34 111.295 173.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 540' ' ' ILE . . . . . 0.45 HG21 ' HB2' ' B' ' 528' ' ' CYS . 1.7 mp -56.82 -48.04 81.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.719 -0.613 . . . . 2.37 110.632 -178.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 541' ' ' ALA . . . . . 0.484 ' O ' ' HG2' ' B' ' 545' ' ' MET . . . -57.44 -44.21 84.55 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 113.514 0.931 . . . . 0.69 113.514 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 542' ' ' SER . . . . . 0.525 ' HB2' ' HE2' ' B' ' 583' ' ' MET . 90.7 p -60.36 -38.78 84.94 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.601 -0.44 . . . . 1.63 110.271 -178.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 543' ' ' ASN . . . . . 0.423 ' O ' HG12 ' B' ' 547' ' ' ILE . 3.1 t-20 -69.06 -47.06 66.28 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 114.362 1.245 . . . . 2.41 114.362 -175.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 544' ' ' ILE . . . . . 0.464 HD13 HD11 ' B' ' 525' ' ' LEU . 23.1 mt -52.66 -45.89 48.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.539 -0.912 . . . . 2.23 108.539 170.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 545' ' ' MET . . . . . 0.692 ' HB3' HG22 ' B' ' 587' ' ' THR . 33.4 mmt -64.05 -42.33 97.07 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 119.659 -0.816 . . . . 3.06 112.833 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -58.28 -48.77 79.41 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 119.189 -1.004 . . . . 2.36 109.893 176.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 547' ' ' ILE . . . . . 0.423 HG12 ' O ' ' B' ' 543' ' ' ASN . 43.3 mm -55.06 -61.48 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.77 0.656 . . . . 2.07 112.77 179.184 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 548' ' ' VAL . . . . . 0.68 HG13 HG22 ' B' ' 565' ' ' VAL . 97.9 t -47.3 -44.27 8.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 119.817 -0.753 . . . . 2.03 111.427 176.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.02 58.81 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.791 -0.568 . . . . 0.0 112.934 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -87.05 -9.55 55.21 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.629 0.604 . . . . 2.85 112.629 -175.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 551' ' ' TYR . . . . . 0.426 ' CG ' HD21 ' B' ' 517' ' ' LEU . 84.7 m-85 -120.45 59.69 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.798 1.036 . . . . 3.84 113.798 -176.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -55.97 -39.36 91.65 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 O-C-N 122.183 0.57 . . . . 0.89 113.162 177.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 553' ' ' ARG . . . . . 0.592 HH21 ' HB2' ' B' ' 510' ' ' GLU . 11.2 ptm180 -56.33 -46.72 79.77 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 121.147 0.499 . . . . 4.49 109.935 -174.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -48.96 -59.72 3.37 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.927 0.891 . . . . 1.05 112.12 167.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 555' ' ' LEU . . . . . 0.64 HD13 HG11 ' B' ' 548' ' ' VAL . 11.1 mp -54.39 -48.49 71.49 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 116.305 -0.407 . . . . 2.09 110.177 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -53.94 -35.88 62.19 Favored 'General case' 0 C--O 1.242 0.682 0 N-CA-C 113.791 1.034 . . . . 3.63 113.791 -178.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.1 -12.16 50.78 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.458 -0.497 . . . . 1.0 112.047 -177.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 17.4 t-160 -128.26 78.51 1.84 Allowed 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.456 1.28 . . . . 3.8 114.456 -177.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -50.48 -48.26 56.76 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 116.584 2.068 . . . . 3.87 116.584 -176.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -56.71 -36.65 69.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.325 -0.398 . . . . 3.79 111.099 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 561' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -74.84 -45.14 45.21 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.095 -1.042 . . . . 1.8 111.916 175.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . 0.529 ' O ' HG12 ' B' ' 565' ' ' VAL . 6.3 tt -49.99 -59.15 4.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.529 0.332 . . . . 1.94 110.226 175.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -50.21 -38.54 40.71 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.912 1.079 . . . . 3.16 113.912 178.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 564' ' ' THR . . . . . 0.494 ' HB ' HD12 ' A' ' 14' ' ' LEU . 24.0 p -71.92 -39.31 69.56 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.498 0.666 . . . . 1.88 110.371 -176.099 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 565' ' ' VAL . . . . . 0.68 HG22 HG13 ' B' ' 548' ' ' VAL . 0.3 OUTLIER -62.83 -41.24 91.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.676 -0.693 . . . . 1.81 112.543 173.361 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 566' ' ' VAL . . . . . . . . . . . . . 85.2 t -71.11 -50.83 39.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 C-N-CA 120.519 -0.473 . . . . 2.0 110.845 -176.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 15.1 m-80 -51.09 -37.42 45.63 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.965 -0.562 . . . . 2.53 112.01 170.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 36.1 mmtm -72.58 -32.76 66.26 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.701 -0.481 . . . . 3.93 109.701 -179.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 569' ' ' LEU . . . . . . . . . . . . . 4.3 mp -67.45 -36.51 81.34 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 108.737 -0.838 . . . . 2.53 108.737 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 570' ' ' PHE . . . . . 0.562 ' HA ' HD13 ' B' ' 621' ' ' ILE . 18.2 m-30 -65.29 -39.35 92.41 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.915 -0.402 . . . . 4.72 109.915 178.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.448 ' O ' ' ND1' ' B' ' 574' ' ' HIS . 36.8 tt0 -57.74 -53.44 58.16 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 119.921 -0.711 . . . . 2.47 110.508 176.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -62.43 -10.0 10.15 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.11 1.152 . . . . 1.87 114.11 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 573' ' ' MET . . . . . 0.492 ' HB3' HD22 ' B' ' 625' ' ' LEU . 54.9 mtt -76.4 -5.31 46.73 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.703 0.763 . . . . 2.56 109.646 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 574' ' ' HIS . . . . . 0.448 ' ND1' ' O ' ' B' ' 571' ' ' GLU . 0.0 OUTLIER -109.48 -0.51 18.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.729 -1.123 . . . . 4.11 111.434 173.792 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 575' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -68.51 130.18 42.11 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 116.217 -0.447 . . . . 1.57 110.094 177.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 3.9 t -87.79 -21.31 25.18 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.984 0.735 . . . . 2.01 112.984 -177.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 30.2 m80 -60.11 128.03 34.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.385 0.612 . . . . 3.71 112.597 -175.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -44.92 125.84 5.39 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.372 -0.831 . . . . 2.15 113.132 -171.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.3 -34.74 4.77 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.203 1.241 . . . . 0.0 116.203 174.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 47.5 t -53.67 -46.36 61.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.195 0.813 . . . . 1.89 113.195 -175.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 22.2 pt20 -59.72 -42.22 92.6 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.406 0.521 . . . . 2.46 112.406 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.54 -42.43 96.52 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.155 0.428 . . . . 2.23 112.155 172.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 583' ' ' MET . . . . . 0.525 ' HE2' ' HB2' ' B' ' 542' ' ' SER . 90.8 mmm -60.72 -49.46 77.41 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.069 -0.252 . . . . 3.01 110.43 175.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.78 -43.0 80.41 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.154 -0.475 . . . . 1.01 111.664 -177.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 585' ' ' CYS . . . . . 0.418 ' O ' HG12 ' B' ' 589' ' ' ILE . 52.7 t -74.38 -40.99 61.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 120.042 -0.663 . . . . 2.2 111.912 -177.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -59.58 -46.34 89.21 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.316 -0.402 . . . . 1.98 111.95 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 587' ' ' THR . . . . . 0.692 HG22 ' HB3' ' B' ' 545' ' ' MET . 36.4 p -62.15 -41.26 98.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.92 110.366 175.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -61.41 -32.25 72.19 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.147 -0.478 . . . . 0.72 111.129 -177.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 589' ' ' ILE . . . . . 0.418 HG12 ' O ' ' B' ' 585' ' ' CYS . 50.3 mm -79.88 -36.02 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 C-N-CA 116.902 -1.919 . . . . 2.46 109.775 -175.339 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -57.4 -50.01 74.35 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 107.75 -1.204 . . . . 3.09 107.75 176.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 83.9 mt -63.84 -43.76 97.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.697 -0.683 . . . . 2.43 112.726 -176.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.96 -39.1 93.37 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.425 -0.51 . . . . 1.01 112.285 177.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -62.38 -70.04 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 119.096 -1.041 . . . . 2.88 109.815 174.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -56.16 -23.72 36.66 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 116.596 2.073 . . . . 2.67 116.596 -176.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 82.8 m -121.71 25.14 9.42 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 114.241 1.2 . . . . 1.97 114.241 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -48.52 -38.47 20.4 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.835 1.791 . . . . 4.07 115.835 -172.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -69.7 -32.54 71.19 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.212 0.819 . . . . 4.32 113.212 -175.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 55.3 m80 -70.16 -3.77 18.36 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.593 -0.731 . . . . 2.88 112.08 -173.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -105.53 -17.01 14.55 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.564 0.54 . . . . 3.7 110.241 -176.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 21.6 t -105.82 -24.37 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.025 -0.989 . . . . 2.05 111.327 -175.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -101.97 139.49 37.53 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 119.566 -0.854 . . . . 2.81 111.576 176.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 11.8 m -60.85 122.69 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.671 -0.863 . . . . 1.99 108.671 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -92.75 167.3 11.97 Favored 'General case' 0 C--O 1.225 -0.213 0 O-C-N 123.659 0.599 . . . . 3.39 110.111 -177.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 34.9 t -71.94 128.96 35.47 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 N-CA-C 112.949 0.722 . . . . 1.91 112.949 -175.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.33 6.59 64.42 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.11 -175.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -131.53 157.99 42.12 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.565 -0.854 . . . . 2.51 110.745 175.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 29.2 t -103.2 -22.62 4.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.029 -0.987 . . . . 2.03 112.496 -175.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 608' ' ' MET . . . . . . . . . . . . . 66.0 mtm -136.91 142.25 37.87 Favored Pre-proline 0 C--O 1.223 -0.302 0 N-CA-C 112.626 0.602 . . . . 3.15 112.626 -174.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 609' ' ' PRO . . . . . 0.53 ' HB2' HG21 ' B' ' 611' ' ' ILE . 9.6 Cg_endo -52.08 130.88 36.85 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.845 1.03 . . . . 0.85 112.131 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -57.02 -31.79 65.49 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.826 0.306 . . . . 3.05 111.826 -174.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 611' ' ' ILE . . . . . 0.53 HG21 ' HB2' ' B' ' 609' ' ' PRO . 5.9 tp -50.1 -44.74 22.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 120.782 0.325 . . . . 2.38 110.577 178.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -49.9 -52.12 35.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.632 0.773 . . . . 2.15 112.855 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 613' ' ' GLU . . . . . 0.544 ' HA ' ' ND2' ' B' ' 616' ' ' ASN . 45.7 mt-10 -59.86 -37.03 78.16 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 120.512 -0.475 . . . . 2.66 110.231 179.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 62.1 mt -64.58 -48.03 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 120.149 -0.62 . . . . 2.28 111.907 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.63 -31.13 71.93 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.959 0.725 . . . . 2.38 112.959 -177.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 616' ' ' ASN . . . . . 0.544 ' ND2' ' HA ' ' B' ' 613' ' ' GLU . 20.6 p30 -79.57 2.15 23.33 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.559 1.318 . . . . 2.62 114.559 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -142.43 15.67 2.02 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 113.114 0.783 . . . . 2.63 113.114 -174.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 618' ' ' ILE . . . . . 0.529 ' O ' HG23 ' B' ' 621' ' ' ILE . 5.0 tp -46.95 -47.01 8.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 C-N-CA 118.973 -1.091 . . . . 2.47 110.135 -176.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 619' ' ' ASN . . . . . 0.4 ' N ' HG21 ' B' ' 618' ' ' ILE . 41.5 t-20 -63.23 -51.07 67.72 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 113.749 1.018 . . . . 2.98 113.749 -176.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 72.6 p -56.9 -31.93 65.39 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.455 -0.898 . . . . 1.94 110.737 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 621' ' ' ILE . . . . . 0.562 HD13 ' HA ' ' B' ' 570' ' ' PHE . 0.4 OUTLIER -79.32 -42.54 23.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 115.362 1.615 . . . . 2.57 115.362 -178.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 622' ' ' ILE . . . . . 0.4 HG12 ' O ' ' B' ' 618' ' ' ILE . 37.6 pt -87.73 -6.27 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.037 1.495 . . . . 2.61 115.037 -177.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 54.0 t -19.9 -58.33 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 116.642 2.09 . . . . 2.06 116.642 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -99.29 -7.56 26.18 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.028 -1.442 . . . . 2.07 110.989 -163.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 625' ' ' LEU . . . . . 0.492 HD22 ' HB3' ' B' ' 573' ' ' MET . 93.7 mt -71.94 146.93 47.46 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.295 0.372 . . . . 2.24 111.694 -173.623 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 626' ' ' GLN . . . . . 0.465 ' O ' HG12 ' B' ' 630' ' ' VAL . 17.3 mp0 -76.74 162.1 71.65 Favored Pre-proline 0 N--CA 1.463 0.189 0 N-CA-C 108.776 -0.824 . . . . 2.99 108.776 174.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 627' ' ' PRO . . . . . 0.522 ' O ' HG22 ' B' ' 630' ' ' VAL . 79.4 Cg_exo -47.81 -43.56 28.89 Favored 'Trans proline' 0 CA--C 1.529 0.243 0 N-CA-C 115.856 1.445 . . . . 0.86 115.856 -178.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -67.36 -43.02 82.47 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.608 -0.516 . . . . 3.24 109.608 -174.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -63.28 -38.33 90.72 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.929 -0.578 . . . . 2.79 110.831 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 630' ' ' VAL . . . . . 0.522 HG22 ' O ' ' B' ' 627' ' ' PRO . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.353 -0.832 . . . . 1.93 110.661 176.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.163 0 N-CA-C 112.429 -0.269 . . . . 10.09 112.429 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.3 t 58.28 21.62 8.4 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.076 0.465 . . . . 8.94 110.783 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -76.2 -27.47 56.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.921 -0.581 . . . . 7.08 111.081 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.2 t -167.47 -74.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 6.5 110.848 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 76.96 37.3 33.5 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.617 -0.801 . . . . 4.42 112.505 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.424 ' O ' ' HG2' ' A' ' 9' ' ' GLU . 18.9 m120 -148.97 -28.36 0.28 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.984 0.421 . . . . 4.56 110.456 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.442 ' HG ' HD13 ' A' ' 10' ' ' LEU . 4.8 tt -81.24 -14.85 57.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.906 -0.588 . . . . 2.59 111.356 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -61.65 -35.69 78.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.406 -0.361 . . . . 4.13 111.852 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 6' ' ' ASN . 12.2 pt-20 -73.94 -24.28 59.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.682 0.277 . . . . 4.17 111.355 -179.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.442 HD13 ' HG ' ' A' ' 7' ' ' LEU . 25.0 mt -67.49 -21.06 65.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.403 -0.362 . . . . 3.01 111.086 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.23 -35.88 35.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 3.23 111.806 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 48.2 tp -60.5 -30.21 69.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.417 -0.356 . . . . 4.01 111.163 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.408 ' O ' HD11 ' B' ' 525' ' ' LEU . 1.4 mptm? -76.62 -34.08 58.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 5.26 111.465 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.615 HD13 HG23 ' B' ' 564' ' ' THR . 2.6 tm? -59.36 -44.34 92.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.505 -0.316 . . . . 3.63 110.831 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.02 -9.5 4.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.311 -0.404 . . . . 3.49 111.536 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -101.24 49.83 1.03 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.813 -0.708 . . . . 3.04 112.719 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.422 HD23 HD13 ' B' ' 525' ' ' LEU . 0.2 OUTLIER -117.41 105.5 12.2 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 110.245 -0.28 . . . . 2.53 110.245 -179.986 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -129.22 134.78 48.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.885 0.374 . . . . 3.92 111.21 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.525 HG23 ' HB2' ' B' ' 537' ' ' LYS . 75.5 mt -90.32 -29.1 4.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 3.25 110.857 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 60.7 m-20 -62.53 -74.08 0.1 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.199 -0.455 . . . . 6.51 111.057 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -171.01 -158.19 0.14 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 9.65 110.902 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.1 m 66.65 125.89 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.052 0.453 . . . . 9.14 111.333 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -145.32 160.8 40.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.98 -0.554 . . . . 11.67 110.697 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -138.25 103.21 0.4 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.623 -0.799 . . . . 12.86 112.588 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -123.28 121.72 36.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.653 0.263 . . . . 15.37 110.823 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -101.56 139.64 36.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.328 -0.396 . . . . 16.54 111.003 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 82.3 m . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.158 -0.925 . . . . 17.97 110.707 179.86 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 504' ' ' ILE . . . . . 0.664 HG13 ' HB2' ' B' ' 507' ' ' ALA . 7.6 tp . . . . . 0 C--O 1.235 0.309 0 N-CA-C 113.076 0.769 . . . . 2.63 113.076 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 80.0 p -48.91 119.12 2.97 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.53 0.567 . . . . 1.82 112.53 174.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.9 1.39 67.67 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 120.964 -0.636 . . . . 0.0 114.37 -179.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 507' ' ' ALA . . . . . 0.664 ' HB2' HG13 ' B' ' 504' ' ' ILE . . . -94.29 -7.56 41.57 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 117.736 0.768 . . . . 1.02 112.405 176.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -112.49 160.02 18.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.191 0.519 . . . . 2.72 112.186 174.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -69.78 134.14 48.23 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.131 -0.692 . . . . 3.51 109.131 174.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -41.57 -35.46 0.73 Allowed 'General case' 0 C--O 1.24 0.567 0 N-CA-C 113.421 0.897 . . . . 2.66 113.421 -173.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.78 -41.96 61.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.505 -0.771 . . . . 2.44 112.082 -176.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.87 -40.04 94.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.133 0.492 . . . . 2.08 110.893 171.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -53.66 -48.76 69.12 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.387 -0.824 . . . . 1.92 111.102 177.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 514' ' ' LYS . . . . . 0.636 ' HB3' ' HZ2' ' B' ' 514' ' ' LYS . 7.3 mtpm? -54.77 -57.67 10.62 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 111.869 0.322 . . . . 3.15 111.869 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -56.59 -35.96 68.82 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.173 0.921 . . . . 4.26 111.086 -177.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.467 ' O ' HG21 ' B' ' 520' ' ' VAL . 62.5 t80 -76.09 -45.6 33.16 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.159 -0.928 . . . . 2.37 110.514 -173.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 517' ' ' LEU . . . . . . . . . . . . . 13.7 tp -66.74 -32.25 73.43 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.731 -0.668 . . . . 2.46 112.615 177.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 518' ' ' VAL . . . . . 0.494 ' O ' ' HB2' ' B' ' 522' ' ' LYS . 69.3 t -67.5 -35.13 72.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 118.58 -1.248 . . . . 2.02 109.081 178.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 74.1 p -72.94 -36.37 67.19 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.82 112.413 178.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 520' ' ' VAL . . . . . 0.467 HG21 ' O ' ' B' ' 516' ' ' PHE . 67.0 t -71.14 -42.45 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 116.46 -0.336 . . . . 1.86 111.638 -174.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 521' ' ' ILE . . . . . . . . . . . . . 17.6 tt -90.65 -25.78 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 115.406 1.632 . . . . 2.46 115.406 -175.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 522' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' B' ' 518' ' ' VAL . 0.3 OUTLIER -60.92 -35.25 76.2 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.599 -0.889 . . . . 2.99 108.599 173.6 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -92.4 -21.35 20.27 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.062 1.504 . . . . 2.17 115.062 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 68.5 mt -70.64 -45.38 65.26 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.3 -0.63 . . . . 2.08 109.3 168.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . 0.422 HD13 HD23 ' A' ' 17' ' ' LEU . 0.6 OUTLIER -52.31 -45.4 65.56 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.2 0.524 . . . . 2.48 110.931 169.778 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.55 -40.47 94.22 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 40.2 mt -63.63 -36.14 82.84 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.043 0.449 . . . . 2.2 111.426 175.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 48.1 t -63.47 -47.74 80.54 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.041 -0.527 . . . . 1.05 110.648 -175.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -61.8 -29.52 70.21 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.472 -0.786 . . . . 2.5 112.517 173.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -71.71 -54.65 9.61 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.353 0.872 . . . . 2.83 113.353 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -68.76 137.94 54.44 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.008 -0.542 . . . . 2.73 111.07 -177.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 532' ' ' ARG . . . . . 0.43 ' HA ' ' NZ ' ' B' ' 537' ' ' LYS . 35.8 mmt180 -96.44 160.67 14.28 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.774 -0.648 . . . . 4.81 110.183 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.44 119.67 1.36 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.984 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 534' ' ' LYS . . . . . 0.608 ' H ' ' HD2' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.18 -36.64 8.92 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.207 0.817 . . . . 3.36 113.207 177.245 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -50.5 -51.85 43.66 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.413 -0.515 . . . . 2.2 110.828 174.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -66.09 -44.85 83.21 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.62 0.6 . . . . 2.09 112.62 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 537' ' ' LYS . . . . . 0.525 ' HB2' HG23 ' A' ' 19' ' ' ILE . 64.6 mttp -67.87 -31.98 72.16 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.93 110.272 -174.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.09 -46.99 69.45 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.839 -0.619 . . . . 1.02 111.115 178.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 75.8 mt -58.12 -55.03 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 121.569 0.699 . . . . 2.34 111.194 173.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 540' ' ' ILE . . . . . . . . . . . . . 94.0 mt -56.81 -48.07 81.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 2.37 110.605 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 541' ' ' ALA . . . . . 0.431 ' O ' ' HG2' ' B' ' 545' ' ' MET . . . -57.49 -43.99 84.6 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 113.583 0.957 . . . . 0.69 113.583 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 94.8 p -60.46 -38.86 85.54 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.647 -0.421 . . . . 1.63 110.215 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 543' ' ' ASN . . . . . 0.446 ' O ' HG12 ' B' ' 547' ' ' ILE . 49.5 t30 -69.05 -47.05 66.35 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 114.352 1.241 . . . . 2.41 114.352 -175.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 544' ' ' ILE . . . . . 0.455 HG13 ' N ' ' B' ' 545' ' ' MET . 48.9 pt -52.63 -45.94 48.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.492 -0.929 . . . . 2.23 108.492 170.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 545' ' ' MET . . . . . 0.455 ' N ' HG13 ' B' ' 544' ' ' ILE . 21.4 mmt -64.03 -42.33 97.12 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.729 -0.788 . . . . 3.06 112.818 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -58.3 -48.78 79.41 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 119.181 -1.007 . . . . 2.36 109.887 176.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 547' ' ' ILE . . . . . 0.446 HG12 ' O ' ' B' ' 543' ' ' ASN . 42.0 mm -55.06 -61.38 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.823 0.675 . . . . 2.07 112.823 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 548' ' ' VAL . . . . . 0.404 HG22 ' HA ' ' B' ' 545' ' ' MET . 36.0 m -47.44 -44.23 9.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 C-N-CA 119.854 -0.738 . . . . 2.03 111.388 176.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.03 58.82 Favored Glycine 0 C--O 1.237 0.336 0 O-C-N 121.791 -0.568 . . . . 0.0 112.917 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 550' ' ' GLN . . . . . 0.576 HE21 ' HA ' ' B' ' 550' ' ' GLN . 0.1 OUTLIER -87.04 -9.58 55.14 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 112.629 0.604 . . . . 2.85 112.629 -175.356 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 551' ' ' TYR . . . . . 0.429 ' O ' HD12 ' B' ' 555' ' ' LEU . 64.4 m-85 -120.38 59.63 6.95 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 113.857 1.058 . . . . 3.84 113.857 -176.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 552' ' ' PRO . . . . . 0.551 ' HG3' ' HG2' ' B' ' 594' ' ' LYS . 15.4 Cg_endo -55.99 -39.35 91.72 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.122 0.538 . . . . 0.89 113.115 178.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 22.0 tpp180 -56.3 -46.81 79.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.134 0.492 . . . . 4.49 109.859 -174.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 554' ' ' PHE . . . . . 0.473 ' HD2' HD13 ' B' ' 555' ' ' LEU . 67.8 t80 -48.88 -59.81 3.27 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.935 0.894 . . . . 1.05 112.098 168.014 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 555' ' ' LEU . . . . . 0.473 HD13 ' HD2' ' B' ' 554' ' ' PHE . 8.2 mp -54.26 -48.62 70.96 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.303 -0.408 . . . . 2.09 110.219 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -53.83 -35.91 61.96 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.831 1.049 . . . . 3.63 113.831 -178.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.03 -12.25 50.76 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.517 -0.473 . . . . 1.0 112.088 -177.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 558' ' ' HIS . . . . . 0.432 ' HE2' ' HE2' ' B' ' 514' ' ' LYS . 32.3 m80 -128.18 78.5 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 3.8 114.388 -177.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 22.0 m-90 -50.52 -48.32 57.18 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 116.534 2.05 . . . . 3.87 116.534 -176.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 560' ' ' LYS . . . . . 0.512 ' HA ' ' HE3' ' B' ' 563' ' ' LYS . 37.8 mtmm -56.48 -36.66 69.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.324 -0.398 . . . . 3.79 111.213 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 561' ' ' PHE . . . . . 0.407 ' O ' HG22 ' B' ' 565' ' ' VAL . 0.7 OUTLIER -74.95 -45.07 44.81 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 119.142 -1.023 . . . . 1.8 111.871 175.613 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . 0.421 ' O ' HG21 ' B' ' 566' ' ' VAL . 3.9 tp -50.01 -59.15 4.17 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.509 0.324 . . . . 1.94 110.258 175.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 563' ' ' LYS . . . . . 0.512 ' HE3' ' HA ' ' B' ' 560' ' ' LYS . 19.6 pttp -50.18 -38.66 40.81 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.896 1.073 . . . . 3.16 113.896 178.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 564' ' ' THR . . . . . 0.615 HG23 HD13 ' A' ' 14' ' ' LEU . 62.4 m -71.74 -39.39 70.1 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.562 0.696 . . . . 1.88 110.413 -176.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 565' ' ' VAL . . . . . 0.407 HG22 ' O ' ' B' ' 561' ' ' PHE . 92.2 t -62.84 -41.34 92.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.646 -0.706 . . . . 1.81 112.527 173.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 566' ' ' VAL . . . . . 0.421 HG21 ' O ' ' B' ' 562' ' ' LEU . 36.2 t -70.93 -50.85 40.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 120.551 -0.46 . . . . 2.0 110.924 -176.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -51.11 -37.38 45.67 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.03 -0.532 . . . . 2.53 111.987 170.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 568' ' ' LYS . . . . . 0.555 ' HZ2' ' HB2' ' B' ' 568' ' ' LYS . 0.6 OUTLIER -72.72 -32.68 65.89 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.599 -0.519 . . . . 3.93 109.599 -179.117 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 569' ' ' LEU . . . . . 0.431 HD23 ' HB2' ' B' ' 588' ' ' PHE . 3.4 mp -67.53 -36.42 80.97 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 108.712 -0.847 . . . . 2.53 108.712 177.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -65.34 -39.39 92.33 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.899 -0.408 . . . . 4.72 109.899 178.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -57.67 -53.46 57.94 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 120.036 -0.665 . . . . 2.47 110.521 176.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -62.57 -9.91 10.36 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.018 1.118 . . . . 1.87 114.018 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 573' ' ' MET . . . . . 0.408 ' HG3' ' O ' ' B' ' 569' ' ' LEU . 65.6 mtt -76.36 -5.29 46.56 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.671 0.748 . . . . 2.56 109.7 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -109.43 -0.54 18.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.73 -1.123 . . . . 4.11 111.465 173.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 575' ' ' GLU . . . . . 0.574 ' HB3' HG13 ' B' ' 580' ' ' VAL . 7.2 tp10 -68.59 130.28 42.38 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.189 -0.46 . . . . 1.57 110.104 177.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 62.2 p -87.92 -21.27 25.03 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 113.006 0.743 . . . . 2.01 113.006 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 577' ' ' HIS . . . . . 0.442 ' O ' HG11 ' B' ' 580' ' ' VAL . 10.7 t60 -60.2 128.02 34.72 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.418 0.628 . . . . 3.71 112.545 -175.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -44.83 125.87 5.32 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.38 -0.827 . . . . 2.15 113.135 -171.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.23 -34.74 4.75 Favored Glycine 0 C--O 1.223 -0.57 0 N-CA-C 116.254 1.262 . . . . 0.0 116.254 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 580' ' ' VAL . . . . . 0.574 HG13 ' HB3' ' B' ' 575' ' ' GLU . 13.6 p -53.82 -46.34 63.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 113.121 0.785 . . . . 1.89 113.121 -175.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.435 ' HG2' ' N ' ' B' ' 582' ' ' ASP . 0.7 OUTLIER -59.67 -42.21 92.37 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.406 0.521 . . . . 2.46 112.406 -179.852 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 582' ' ' ASP . . . . . 0.481 ' HA ' ' OE1' ' B' ' 629' ' ' GLN . 19.3 t70 -60.54 -42.5 96.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.149 0.425 . . . . 2.23 112.149 172.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 583' ' ' MET . . . . . 0.492 ' HE3' ' HA ' ' B' ' 583' ' ' MET . 31.8 mmt -60.66 -49.49 77.29 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 121.109 -0.236 . . . . 3.01 110.439 175.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.87 -42.87 80.54 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.176 -0.465 . . . . 1.01 111.74 -177.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 44.4 t -74.43 -40.92 61.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 120.009 -0.676 . . . . 2.2 111.957 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.58 -46.31 89.3 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.306 -0.406 . . . . 1.98 111.95 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 587' ' ' THR . . . . . 0.439 ' HG1' ' HB3' ' B' ' 545' ' ' MET . 41.0 m -62.15 -41.25 98.11 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.329 0.652 . . . . 1.92 110.413 175.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 588' ' ' PHE . . . . . 0.431 ' HB2' HD23 ' B' ' 569' ' ' LEU . 87.0 t80 -61.52 -32.15 72.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.007 -0.542 . . . . 0.72 111.125 -177.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 589' ' ' ILE . . . . . . . . . . . . . 47.4 mm -79.86 -36.0 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.871 -1.932 . . . . 2.46 109.8 -175.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -57.44 -50.01 74.39 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 107.713 -1.218 . . . . 3.09 107.713 176.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 98.2 mt -63.82 -43.82 98.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 112.786 0.661 . . . . 2.43 112.786 -177.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.83 -39.14 93.52 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.291 0.478 . . . . 1.01 112.291 177.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -62.32 -70.14 0.22 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.155 -1.018 . . . . 2.88 109.772 174.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 594' ' ' LYS . . . . . 0.551 ' HG2' ' HG3' ' B' ' 552' ' ' PRO . 2.3 mppt? -56.11 -23.84 36.81 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.562 2.06 . . . . 2.67 116.562 -176.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 83.6 m -121.67 25.22 9.4 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.263 1.209 . . . . 1.97 114.263 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 596' ' ' ARG . . . . . 0.527 ' HA ' ' CE2' ' B' ' 599' ' ' PHE . 34.4 ptt180 -48.52 -38.54 20.57 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.83 1.789 . . . . 4.07 115.83 -172.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 68.7 mtm180 -69.52 -32.61 71.56 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.214 0.82 . . . . 4.32 113.214 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -3.81 18.68 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.577 -0.738 . . . . 2.88 112.052 -173.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 599' ' ' PHE . . . . . 0.527 ' CE2' ' HA ' ' B' ' 596' ' ' ARG . 0.1 OUTLIER -105.62 -16.89 14.57 Favored 'General case' 0 CA--C 1.517 -0.32 0 O-C-N 123.621 0.576 . . . . 3.7 110.158 -176.552 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . 0.455 ' N ' ' HD1' ' B' ' 599' ' ' PHE . 9.4 p -105.82 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.162 -0.926 . . . . 2.05 111.327 -175.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -102.04 139.52 37.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 119.551 -0.86 . . . . 2.81 111.596 176.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 3.9 p -60.89 122.74 12.14 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 108.597 -0.89 . . . . 1.99 108.597 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -92.76 167.3 11.97 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 123.675 0.609 . . . . 3.39 110.086 -177.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 7.4 p -71.94 129.01 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 N-CA-C 112.927 0.714 . . . . 1.91 112.927 -175.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.31 6.53 64.51 Favored Glycine 0 N--CA 1.446 -0.7 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.111 -175.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 606' ' ' GLU . . . . . 0.487 ' HG3' ' H ' ' B' ' 608' ' ' MET . 8.3 tp10 -131.5 158.0 42.04 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.557 -0.857 . . . . 2.51 110.746 175.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 16.7 t -103.27 -22.55 4.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.032 -0.985 . . . . 2.03 112.451 -175.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 608' ' ' MET . . . . . 0.487 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 88.2 mtp -136.95 142.28 37.94 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.672 0.619 . . . . 3.15 112.672 -174.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -52.08 130.88 36.86 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.85 112.131 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -57.02 -31.76 65.46 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.826 0.306 . . . . 3.05 111.826 -174.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 611' ' ' ILE . . . . . 0.514 HG12 ' O ' ' B' ' 599' ' ' PHE . 6.4 pt -50.05 -44.87 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 120.784 0.326 . . . . 2.38 110.513 178.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 612' ' ' ASP . . . . . 0.438 ' H ' HG13 ' B' ' 611' ' ' ILE . 24.8 m-20 -49.94 -52.01 36.69 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.621 0.769 . . . . 2.15 112.844 177.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -59.94 -37.14 78.65 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.613 -0.435 . . . . 2.66 110.175 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 65.2 mt -64.51 -48.02 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.214 -0.594 . . . . 2.28 111.961 178.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 615' ' ' LEU . . . . . 0.544 HD11 HD12 ' B' ' 618' ' ' ILE . 4.5 mm? -62.63 -31.11 71.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.958 0.725 . . . . 2.38 112.958 -177.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -79.54 2.14 23.3 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.662 1.356 . . . . 2.62 114.662 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -142.42 15.61 2.02 Favored 'General case' 0 C--O 1.243 0.72 0 N-CA-C 113.152 0.797 . . . . 2.63 113.152 -174.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 618' ' ' ILE . . . . . 0.544 HD12 HD11 ' B' ' 615' ' ' LEU . 72.0 mt -46.83 -47.14 8.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 118.997 -1.081 . . . . 2.47 110.176 -176.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 619' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -63.09 -51.14 67.79 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.744 1.016 . . . . 2.98 113.744 -176.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 32.6 m -56.92 -31.87 65.38 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 119.487 -0.885 . . . . 1.94 110.743 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 621' ' ' ILE . . . . . . . . . . . . . 64.6 mt -79.32 -42.7 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 115.334 1.605 . . . . 2.57 115.334 -178.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 622' ' ' ILE . . . . . . . . . . . . . 47.2 pt -87.5 -6.48 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 115.059 1.503 . . . . 2.61 115.059 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 8.7 p -19.91 -58.3 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.575 2.065 . . . . 2.06 116.575 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -99.26 -7.57 26.23 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 114.045 -1.434 . . . . 2.07 111.043 -163.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 625' ' ' LEU . . . . . . . . . . . . . 96.0 mt -71.93 146.9 47.51 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 123.286 0.366 . . . . 2.24 111.601 -173.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 626' ' ' GLN . . . . . 0.409 ' O ' HG23 ' B' ' 630' ' ' VAL . 1.7 mp0 -76.74 162.09 71.7 Favored Pre-proline 0 CA--C 1.52 -0.191 0 N-CA-C 108.835 -0.802 . . . . 2.99 108.835 174.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -47.85 -43.58 29.09 Favored 'Trans proline' 0 C--O 1.233 0.256 0 N-CA-C 115.765 1.409 . . . . 0.86 115.765 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 628' ' ' GLN . . . . . 0.566 ' HG3' HE21 ' B' ' 629' ' ' GLN . 20.9 pt20 -67.33 -42.98 82.67 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.637 -0.505 . . . . 3.24 109.637 -174.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 629' ' ' GLN . . . . . 0.566 HE21 ' HG3' ' B' ' 628' ' ' GLN . 29.1 mm-40 -63.31 -38.23 90.35 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.924 -0.58 . . . . 2.79 110.924 178.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 630' ' ' VAL . . . . . 0.409 HG23 ' O ' ' B' ' 626' ' ' GLN . 95.1 t . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.315 -0.85 . . . . 1.93 110.685 176.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 112.36 -0.296 . . . . 10.09 112.36 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.8 m -135.91 38.42 2.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.837 0.351 . . . . 8.94 110.875 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 58.76 27.45 16.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.08 -0.509 . . . . 7.08 111.237 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.5 t -96.24 137.97 34.54 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.186 -0.461 . . . . 6.5 111.189 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 103.06 116.76 4.24 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.94 -0.648 . . . . 4.42 112.599 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -149.59 -49.03 0.14 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.651 0.262 . . . . 4.56 110.711 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.569 HD23 ' HE2' ' B' ' 514' ' ' LYS . 3.9 mm? -55.56 -30.43 60.77 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.387 -0.37 . . . . 2.59 110.991 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -62.06 -34.77 76.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.299 -0.41 . . . . 4.13 110.906 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -76.6 -33.12 58.44 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.179 -0.464 . . . . 4.17 110.872 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.604 HD21 HG23 ' B' ' 518' ' ' VAL . 10.4 mp -56.5 -35.38 67.94 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.997 0.427 . . . . 3.01 110.633 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.97 -34.36 38.73 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.012 -0.54 . . . . 3.23 110.809 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.4 tp -69.33 -19.71 63.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.923 -0.581 . . . . 4.01 110.413 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 52.0 tptt -80.35 -21.11 42.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.93 -0.577 . . . . 5.26 111.068 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.485 HD21 ' HD3' ' B' ' 568' ' ' LYS . 0.7 OUTLIER -66.49 -10.36 43.74 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.36 -0.382 . . . . 3.63 110.587 -179.875 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.24 -30.02 25.59 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.236 -0.438 . . . . 3.49 111.231 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -84.18 -113.52 0.63 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.721 -0.752 . . . . 3.04 112.226 179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.433 HD13 ' SG ' ' B' ' 528' ' ' CYS . 38.0 tp 55.41 81.25 0.12 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.98 0.419 . . . . 2.53 110.853 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.554 ' HB2' ' HZ3' ' B' ' 537' ' ' LYS . 3.4 m-20 -81.98 142.76 32.11 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.1 -0.5 . . . . 3.92 111.058 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 8.9 tp -172.62 -22.68 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 3.25 110.591 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -127.82 117.15 21.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.055 -0.521 . . . . 6.51 110.887 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.4 ttpp 63.24 113.81 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.988 -0.551 . . . . 9.65 111.495 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.9 m -120.41 126.44 50.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.06 -0.518 . . . . 9.14 110.867 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -91.7 -22.71 20.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.294 -0.412 . . . . 11.67 111.003 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 80.21 -112.89 3.53 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.701 -0.761 . . . . 12.86 112.276 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 55.44 75.01 0.34 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.911 0.386 . . . . 15.37 110.893 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -73.65 101.12 3.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.068 -0.514 . . . . 16.54 110.852 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 21.6 p . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.085 -0.959 . . . . 17.97 111.681 179.93 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 44.7 pt . . . . . 0 C--O 1.237 0.419 0 N-CA-C 113.015 0.746 . . . . 2.63 113.015 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 78.4 p -48.83 119.11 2.94 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.519 0.563 . . . . 1.82 112.519 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.76 1.53 67.92 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 120.961 -0.638 . . . . 0.0 114.436 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.39 -7.52 41.35 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 117.685 0.742 . . . . 1.02 112.434 176.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 67.5 mtt -112.45 159.97 18.22 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.116 0.484 . . . . 2.72 112.263 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 72.8 m80 -69.73 134.28 48.45 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.042 -0.725 . . . . 3.51 109.042 174.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -41.73 -35.32 0.76 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.409 0.892 . . . . 2.66 113.409 -173.255 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -73.88 -41.88 61.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.598 -0.728 . . . . 2.44 112.097 -176.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -64.85 -40.18 94.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.184 0.516 . . . . 2.08 110.823 171.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -53.61 -48.67 69.07 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.347 -0.842 . . . . 1.92 111.199 177.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 514' ' ' LYS . . . . . 0.569 ' HE2' HD23 ' A' ' 7' ' ' LEU . 50.4 tttm -54.91 -57.53 11.24 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 111.912 0.338 . . . . 3.15 111.912 179.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -56.71 -35.92 69.07 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 124.16 0.913 . . . . 4.26 111.037 -177.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.442 ' O ' HG22 ' B' ' 520' ' ' VAL . 86.1 t80 -76.12 -45.52 33.33 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.191 -0.913 . . . . 2.37 110.539 -173.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 517' ' ' LEU . . . . . 0.43 ' O ' HG23 ' B' ' 521' ' ' ILE . 0.2 OUTLIER -66.8 -32.2 73.33 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.738 -0.665 . . . . 2.46 112.658 177.104 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 518' ' ' VAL . . . . . 0.604 HG23 HD21 ' A' ' 10' ' ' LEU . 3.2 p -67.49 -35.14 72.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 118.483 -1.287 . . . . 2.02 109.031 178.538 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 76.3 p -73.02 -36.3 66.94 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.348 0.594 . . . . 1.82 112.401 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 520' ' ' VAL . . . . . 0.442 HG22 ' O ' ' B' ' 516' ' ' PHE . 55.5 t -71.25 -42.24 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 122.162 -0.336 . . . . 1.86 111.702 -174.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 521' ' ' ILE . . . . . 0.43 HG23 ' O ' ' B' ' 517' ' ' LEU . 13.5 tt -90.73 -25.83 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 115.42 1.637 . . . . 2.46 115.42 -175.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -60.77 -35.19 75.81 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.712 -0.847 . . . . 2.99 108.712 173.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -92.5 -21.44 20.14 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 115.001 1.482 . . . . 2.17 115.001 -177.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 70.1 mt -70.69 -45.27 65.33 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.314 -0.624 . . . . 2.08 109.314 168.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 70.1 mt -52.32 -45.42 65.59 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.315 0.579 . . . . 2.48 110.962 169.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.47 -40.53 94.38 Favored Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.63 -36.14 82.83 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.036 0.446 . . . . 2.2 111.426 175.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 528' ' ' CYS . . . . . 0.433 ' SG ' HD13 ' A' ' 17' ' ' LEU . 40.2 t -63.54 -47.68 80.61 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.023 -0.535 . . . . 1.05 110.699 -175.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.67 -29.6 70.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.485 -0.78 . . . . 2.5 112.566 173.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -71.78 -54.68 9.42 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.283 0.846 . . . . 2.83 113.283 -177.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 531' ' ' LYS . . . . . 0.546 ' HD2' HD11 ' B' ' 540' ' ' ILE . 80.0 mttt -68.73 137.89 54.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.065 -0.516 . . . . 2.73 111.047 -177.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -96.42 160.63 14.31 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.837 -0.619 . . . . 4.81 110.158 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.47 119.58 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.848 -0.614 . . . . 0.0 114.022 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -47.02 -36.66 8.14 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.259 0.837 . . . . 3.36 113.259 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 535' ' ' ASP . . . . . 0.55 ' HA ' ' HE2' ' B' ' 577' ' ' HIS . 6.3 p-10 -50.56 -51.85 44.32 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.373 -0.531 . . . . 2.2 110.809 174.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.06 -44.83 83.37 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.62 0.6 . . . . 2.09 112.62 178.314 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 537' ' ' LYS . . . . . 0.554 ' HZ3' ' HB2' ' A' ' 18' ' ' ASP . 65.7 mttm -67.87 -31.9 72.03 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.93 110.272 -174.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.21 -47.0 69.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.862 -0.608 . . . . 1.02 111.048 178.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 48.4 mm -58.12 -54.98 25.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 121.549 0.69 . . . . 2.34 111.234 173.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 540' ' ' ILE . . . . . 0.546 HD11 ' HD2' ' B' ' 531' ' ' LYS . 80.7 mt -56.75 -48.14 81.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 2.37 110.59 -178.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.46 -44.09 84.52 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 113.595 0.961 . . . . 0.69 113.595 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 62.3 m -60.42 -38.81 85.23 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 120.545 -0.462 . . . . 1.63 110.306 -178.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 40.5 t-20 -68.92 -47.12 66.54 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 114.365 1.246 . . . . 2.41 114.365 -175.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 544' ' ' ILE . . . . . . . . . . . . . 95.1 mt -52.6 -46.06 48.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.424 -0.954 . . . . 2.23 108.424 170.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 545' ' ' MET . . . . . 0.718 ' HB3' HG21 ' B' ' 587' ' ' THR . 45.3 mtp -63.97 -42.33 97.28 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.78 -0.768 . . . . 3.06 112.818 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -58.35 -48.71 79.7 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 119.145 -1.022 . . . . 2.36 109.932 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 80.8 mt -55.07 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.8 0.667 . . . . 2.07 112.8 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 548' ' ' VAL . . . . . 0.405 HG22 ' HA ' ' B' ' 545' ' ' MET . 33.8 m -47.42 -44.17 9.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.812 -0.755 . . . . 2.03 111.427 176.265 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 549' ' ' GLY . . . . . 0.53 ' HA2' HD13 ' B' ' 591' ' ' ILE . . . -57.41 -28.08 58.9 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -86.99 -9.57 55.26 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.614 0.598 . . . . 2.85 112.614 -175.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -120.43 59.74 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.781 1.03 . . . . 3.84 113.781 -176.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.03 -39.36 91.69 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 O-C-N 122.071 0.511 . . . . 0.89 113.134 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 9.9 mmm180 -56.23 -46.78 79.4 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 121.169 0.509 . . . . 4.49 109.974 -174.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -48.9 -59.84 3.25 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 123.89 0.876 . . . . 1.05 112.101 167.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 555' ' ' LEU . . . . . . . . . . . . . 11.2 mp -54.26 -48.56 71.05 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 116.267 -0.424 . . . . 2.09 110.202 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 556' ' ' ARG . . . . . 0.459 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 78.6 ttt180 -53.93 -35.87 62.16 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 113.827 1.047 . . . . 3.63 113.827 -178.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.06 -12.17 50.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.517 -0.473 . . . . 1.0 112.102 -177.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -128.23 78.5 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 3.8 114.388 -177.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 33.4 p90 -50.51 -48.28 57.06 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 116.57 2.063 . . . . 3.87 116.57 -176.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -56.57 -36.68 69.62 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.23 -0.441 . . . . 3.79 111.136 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 561' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -74.89 -45.08 45.24 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.092 -1.043 . . . . 1.8 111.978 175.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 562' ' ' LEU . . . . . . . . . . . . . 2.9 tt -49.99 -59.13 4.18 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 122.403 0.281 . . . . 1.94 110.34 175.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 563' ' ' LYS . . . . . 0.472 ' HZ1' HD22 ' B' ' 567' ' ' ASN . 0.2 OUTLIER -50.14 -38.63 40.18 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.922 1.082 . . . . 3.16 113.922 178.802 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 20.1 p -71.89 -39.31 69.66 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.732 -0.667 . . . . 1.88 110.356 -176.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 565' ' ' VAL . . . . . . . . . . . . . 68.5 t -62.81 -41.31 92.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.685 -0.689 . . . . 1.81 112.542 173.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 566' ' ' VAL . . . . . 0.431 HG22 ' HZ ' ' B' ' 599' ' ' PHE . 58.1 t -71.0 -50.93 39.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.542 -0.463 . . . . 2.0 110.844 -176.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 567' ' ' ASN . . . . . 0.472 HD22 ' HZ1' ' B' ' 563' ' ' LYS . 91.1 m-20 -51.08 -37.37 45.32 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.996 -0.547 . . . . 2.53 112.012 170.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 568' ' ' LYS . . . . . 0.485 ' HD3' HD21 ' A' ' 14' ' ' LEU . 29.2 ttpt -72.67 -32.6 65.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.753 -0.462 . . . . 3.93 109.753 -179.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 569' ' ' LEU . . . . . 0.469 ' O ' ' HG3' ' B' ' 573' ' ' MET . 4.2 mp -67.46 -36.5 81.28 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.73 -0.841 . . . . 2.53 108.73 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 570' ' ' PHE . . . . . 0.519 ' HD1' HG13 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.38 -39.38 92.17 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.872 -0.418 . . . . 4.72 109.872 178.372 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -57.66 -53.45 58.06 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 119.999 -0.68 . . . . 2.47 110.545 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.56 -9.86 10.16 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.079 1.14 . . . . 1.87 114.079 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 573' ' ' MET . . . . . 0.649 ' HB3' HD13 ' B' ' 625' ' ' LEU . 64.0 mtt -76.42 -5.35 46.93 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.639 0.733 . . . . 2.56 109.662 178.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -109.4 -0.48 18.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.755 -1.112 . . . . 4.11 111.428 173.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 575' ' ' GLU . . . . . 0.423 ' HG2' HG12 ' B' ' 580' ' ' VAL . 14.4 tp10 -68.48 130.2 42.17 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.214 -0.448 . . . . 1.57 110.079 177.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 7.2 m -87.87 -21.24 25.1 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.042 0.756 . . . . 2.01 113.042 -177.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 577' ' ' HIS . . . . . 0.55 ' HE2' ' HA ' ' B' ' 535' ' ' ASP . 0.8 OUTLIER -60.22 128.03 34.75 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.411 0.624 . . . . 3.71 112.596 -175.4 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 578' ' ' ASP . . . . . 0.549 ' H ' ' HD1' ' B' ' 577' ' ' HIS . 7.1 m-20 -44.88 125.88 5.38 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.388 -0.824 . . . . 2.15 113.063 -171.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.26 -34.75 4.75 Favored Glycine 0 C--O 1.222 -0.627 0 N-CA-C 116.29 1.276 . . . . 0.0 116.29 174.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 580' ' ' VAL . . . . . 0.423 HG12 ' HG2' ' B' ' 575' ' ' GLU . 58.1 t -53.68 -46.42 61.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.146 0.795 . . . . 1.89 113.146 -175.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -59.6 -42.31 92.29 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.383 0.512 . . . . 2.46 112.383 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 582' ' ' ASP . . . . . 0.53 ' HA ' ' HG ' ' B' ' 585' ' ' CYS . 17.3 t70 -60.54 -42.42 96.46 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.213 0.449 . . . . 2.23 112.213 172.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 25.7 mmt -60.71 -49.48 77.32 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.058 -0.257 . . . . 3.01 110.447 175.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.86 -42.83 80.46 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.159 -0.473 . . . . 1.01 111.79 -177.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 585' ' ' CYS . . . . . 0.53 ' HG ' ' HA ' ' B' ' 582' ' ' ASP . 23.6 p -74.4 -40.92 61.73 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 119.957 -0.697 . . . . 2.2 111.984 -177.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 586' ' ' ASP . . . . . 0.462 ' O ' HG12 ' B' ' 589' ' ' ILE . 18.0 t70 -59.53 -46.38 89.04 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.273 -0.421 . . . . 1.98 111.92 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 587' ' ' THR . . . . . 0.718 HG21 ' HB3' ' B' ' 545' ' ' MET . 40.4 p -62.19 -41.18 98.1 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.92 110.43 175.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -61.55 -32.14 72.2 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.035 -0.53 . . . . 0.72 111.153 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 589' ' ' ILE . . . . . 0.462 HG12 ' O ' ' B' ' 586' ' ' ASP . 41.5 pt -79.94 -35.85 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.871 -1.932 . . . . 2.46 109.76 -175.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -57.52 -50.04 74.38 Favored 'General case' 0 C--O 1.221 -0.438 0 N-CA-C 107.701 -1.222 . . . . 3.09 107.701 176.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . 0.53 HD13 ' HA2' ' B' ' 549' ' ' GLY . 1.7 mp -63.77 -43.74 98.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.689 -0.687 . . . . 2.43 112.815 -176.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.04 93.23 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.392 -0.523 . . . . 1.01 112.301 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -62.4 -70.06 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 119.112 -1.035 . . . . 2.88 109.793 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -56.09 -23.84 36.41 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 116.608 2.077 . . . . 2.67 116.608 -176.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.1 p -121.68 25.25 9.38 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 114.201 1.186 . . . . 1.97 114.201 -178.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -48.46 -38.6 20.37 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 115.825 1.787 . . . . 4.07 115.825 -172.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 54.8 mtp180 -69.54 -32.63 71.55 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.201 0.815 . . . . 4.32 113.201 -175.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 598' ' ' HIS . . . . . 0.459 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 61.9 m-70 -70.2 -3.77 18.51 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.603 -0.726 . . . . 2.88 112.05 -173.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 599' ' ' PHE . . . . . 0.431 ' HZ ' HG22 ' B' ' 566' ' ' VAL . 3.2 m-85 -105.52 -16.95 14.57 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 123.597 0.561 . . . . 3.7 110.257 -176.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 15.0 p -105.76 -24.38 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.091 -0.959 . . . . 2.05 111.319 -175.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -102.03 139.51 37.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.578 -0.849 . . . . 2.81 111.55 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 16.1 m -60.89 122.71 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.611 -0.885 . . . . 1.99 108.611 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -92.78 167.29 11.96 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 123.648 0.592 . . . . 3.39 110.06 -177.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 42.9 t -71.93 128.93 35.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 N-CA-C 112.971 0.73 . . . . 1.91 112.971 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.38 6.53 64.38 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.062 -175.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 606' ' ' GLU . . . . . 0.457 ' HG2' ' H ' ' B' ' 608' ' ' MET . 34.7 tt0 -131.49 158.01 42.03 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.626 -0.83 . . . . 2.51 110.756 175.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 19.1 t -103.28 -22.55 4.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.055 -0.975 . . . . 2.03 112.451 -175.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 608' ' ' MET . . . . . 0.457 ' H ' ' HG2' ' B' ' 606' ' ' GLU . 96.4 mmm -136.96 142.21 37.67 Favored Pre-proline 0 C--O 1.222 -0.343 0 N-CA-C 112.615 0.598 . . . . 3.15 112.615 -174.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 609' ' ' PRO . . . . . 0.537 ' HB2' HG22 ' B' ' 611' ' ' ILE . 10.3 Cg_endo -52.13 130.85 36.91 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 120.83 1.02 . . . . 0.85 112.162 179.224 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -56.9 -31.85 65.3 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.866 0.321 . . . . 3.05 111.866 -174.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 611' ' ' ILE . . . . . 0.537 HG22 ' HB2' ' B' ' 609' ' ' PRO . 6.7 tp -50.0 -44.88 22.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 CA-C-O 120.787 0.327 . . . . 2.38 110.555 178.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 612' ' ' ASP . . . . . 0.439 ' OD1' ' HG2' ' B' ' 609' ' ' PRO . 0.9 OUTLIER -49.86 -52.0 36.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.612 0.765 . . . . 2.15 112.875 177.698 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -59.95 -37.13 78.67 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.606 -0.438 . . . . 2.66 110.175 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 62.7 mt -64.55 -47.96 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.117 -0.633 . . . . 2.28 111.968 178.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 615' ' ' LEU . . . . . 0.448 HD11 HD13 ' B' ' 618' ' ' ILE . 57.2 tp -62.6 -31.13 71.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.955 0.724 . . . . 2.38 112.955 -177.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -79.57 2.11 23.46 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.599 1.333 . . . . 2.62 114.599 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 617' ' ' ASN . . . . . 0.527 ' HB3' HG23 ' B' ' 620' ' ' THR . 12.3 m120 -142.48 15.79 2.01 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 113.104 0.779 . . . . 2.63 113.104 -174.259 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 618' ' ' ILE . . . . . 0.448 HD13 HD11 ' B' ' 615' ' ' LEU . 81.0 mt -46.93 -47.06 8.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 C-N-CA 118.929 -1.109 . . . . 2.47 110.177 -176.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 619' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -63.19 -51.1 67.7 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.703 1.001 . . . . 2.98 113.703 -176.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 620' ' ' THR . . . . . 0.527 HG23 ' HB3' ' B' ' 617' ' ' ASN . 8.8 t -56.94 -31.82 65.35 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.46 -0.896 . . . . 1.94 110.741 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 621' ' ' ILE . . . . . 0.519 HG13 ' HD1' ' B' ' 570' ' ' PHE . 15.7 tt -79.36 -42.67 23.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 115.267 1.58 . . . . 2.57 115.267 -178.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 622' ' ' ILE . . . . . 0.481 HG12 HG23 ' B' ' 630' ' ' VAL . 0.2 OUTLIER -87.7 -6.27 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.011 1.485 . . . . 2.61 115.011 -177.586 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.7 t -20.05 -58.28 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 116.538 2.051 . . . . 2.06 116.538 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -99.33 -7.53 26.16 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.061 -1.427 . . . . 2.07 111.007 -163.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 625' ' ' LEU . . . . . 0.649 HD13 ' HB3' ' B' ' 573' ' ' MET . 9.0 mp -71.87 146.85 47.64 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 123.326 0.391 . . . . 2.24 111.769 -173.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 626' ' ' GLN . . . . . 0.492 ' O ' HG22 ' B' ' 630' ' ' VAL . 11.8 pt20 -76.69 162.08 71.8 Favored Pre-proline 0 CA--C 1.519 -0.22 0 N-CA-C 108.843 -0.799 . . . . 2.99 108.843 174.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -47.86 -43.63 29.0 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.792 1.42 . . . . 0.86 115.792 -178.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -67.29 -43.07 82.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.573 -0.528 . . . . 3.24 109.573 -174.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 629' ' ' GLN . . . . . 0.453 ' HG3' ' SG ' ' B' ' 585' ' ' CYS . 1.1 mp0 -63.18 -38.37 90.89 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.934 -0.575 . . . . 2.79 110.928 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 630' ' ' VAL . . . . . 0.492 HG22 ' O ' ' B' ' 626' ' ' GLN . 59.8 t . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.207 -0.901 . . . . 1.93 110.687 176.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 39.5 pt . . . . . 0 C--O 1.236 0.342 0 N-CA-C 113.024 0.75 . . . . 2.1299999999999999 113.024 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 80.5 p -48.89 119.18 3.01 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.576 0.584 . . . . 1.29 112.576 174.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.82 1.43 67.84 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 120.913 -0.66 . . . . 0.0 114.476 -179.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.33 -7.63 41.25 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 117.659 0.73 . . . . 0.02 112.431 176.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 86.4 mtp -112.41 159.96 18.2 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.29 0.478 . . . . 2.21 112.29 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -69.67 134.24 48.46 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 109.146 -0.687 . . . . 2.6699999999999999 109.146 174.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -41.71 -35.42 0.78 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.37 0.878 . . . . 2.6600000000000001 113.37 -173.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -73.84 -41.89 61.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.584 -0.734 . . . . 2.4399999999999999 112.07 -176.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -64.83 -40.11 94.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.158 0.504 . . . . 2.0800000000000001 110.88 171.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -53.72 -48.58 69.46 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.303 -0.862 . . . . 1.9199999999999999 111.205 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -54.85 -57.6 10.94 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 111.9 0.333 . . . . 2.73 111.9 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 515' ' ' ARG . . . . . 0.479 ' O ' HG12 ' B' ' 518' ' ' VAL . 81.2 mtp180 -56.63 -35.93 68.9 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.157 0.911 . . . . 3.75 111.086 -177.511 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.699 ' O ' HG13 ' B' ' 520' ' ' VAL . 76.5 t80 -76.14 -45.56 33.01 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.104 -0.953 . . . . 1.8899999999999999 110.504 -173.337 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 517' ' ' LEU . . . . . 0.759 ' HA ' HG22 ' B' ' 520' ' ' VAL . 8.5 tp -66.76 -32.23 73.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.731 -0.668 . . . . 1.8999999999999999 112.591 177.186 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 518' ' ' VAL . . . . . 0.479 HG12 ' O ' ' B' ' 515' ' ' ARG . 7.7 p -67.57 -35.07 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 118.483 -1.287 . . . . 1.3999999999999999 109.021 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 42.8 m -72.9 -36.38 67.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.41 0.624 . . . . 1.1799999999999999 112.444 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 520' ' ' VAL . . . . . 0.786 HG23 HG13 ' B' ' 521' ' ' ILE . 25.5 m -71.21 -42.3 75.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.395 -0.366 . . . . 1.22 111.636 -174.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 521' ' ' ILE . . . . . 0.786 HG13 HG23 ' B' ' 520' ' ' VAL . 82.4 mt -90.69 -25.86 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 N-CA-C 115.418 1.636 . . . . 1.98 115.418 -175.097 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -60.82 -35.16 75.81 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.717 -0.845 . . . . 2.5699999999999998 108.717 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -92.4 -21.62 20.11 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.032 1.493 . . . . 2.1699999999999999 115.032 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 524' ' ' LEU . . . . . 0.635 HD23 ' HB ' ' B' ' 544' ' ' ILE . 16.4 tp -70.53 -45.45 65.51 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 109.325 -0.621 . . . . 1.48 109.325 168.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 43.2 tp -52.15 -45.52 65.06 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-O 121.211 0.529 . . . . 1.95 110.953 169.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.46 -40.57 94.42 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 527' ' ' LEU . . . . . 0.401 HD23 HD12 ' B' ' 540' ' ' ILE . 52.2 tp -63.53 -36.16 82.87 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.057 0.456 . . . . 1.6699999999999999 111.483 175.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 49.9 t -63.47 -47.74 80.58 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.012 -0.54 . . . . 0.58999999999999997 110.705 -175.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -61.68 -29.65 70.22 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.508 -0.769 . . . . 2.5 112.56 173.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -71.65 -54.71 9.49 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.369 0.877 . . . . 2.2400000000000002 113.369 -177.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -68.76 137.99 54.49 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.98 -0.555 . . . . 2.2799999999999998 111.031 -177.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -96.49 160.72 14.25 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.749 -0.66 . . . . 4.21 110.19 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.64 1.35 Allowed Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.912 -0.585 . . . . 0.0 114.031 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -47.18 -36.61 8.89 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 113.175 0.805 . . . . 2.9500000000000002 113.175 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -50.53 -51.86 43.88 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.376 -0.53 . . . . 2.2000000000000002 110.823 174.477 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -66.05 -44.85 83.37 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.62 0.6 . . . . 1.47 112.62 178.344 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 537' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -67.87 -31.95 72.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.272 -174.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.12 -46.96 69.45 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 115.815 -0.629 . . . . 0.040000000000000001 111.149 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 74.4 mt -58.24 -54.9 26.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 1.8200000000000001 111.218 173.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 540' ' ' ILE . . . . . 0.401 HD12 HD23 ' B' ' 527' ' ' LEU . 47.0 mm -56.73 -48.17 81.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.601 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 541' ' ' ALA . . . . . 0.412 ' O ' ' CG2' ' B' ' 544' ' ' ILE . . . -57.48 -43.98 84.54 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 113.599 0.963 . . . . 0.02 113.599 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 542' ' ' SER . . . . . 0.56 ' HA ' ' HE3' ' B' ' 545' ' ' MET . 92.5 p -60.54 -38.7 85.31 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.557 -0.457 . . . . 1.2 110.301 -178.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -69.1 -47.07 66.14 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 114.298 1.221 . . . . 2.0299999999999998 114.298 -175.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 544' ' ' ILE . . . . . 0.635 ' HB ' HD23 ' B' ' 524' ' ' LEU . 7.8 tt -52.6 -45.92 48.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 108.52 -0.919 . . . . 1.8100000000000001 108.52 170.07 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 545' ' ' MET . . . . . 0.56 ' HE3' ' HA ' ' B' ' 542' ' ' SER . 74.5 mtm -64.03 -42.33 97.13 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.744 -0.782 . . . . 2.6000000000000001 112.766 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -58.39 -48.73 79.68 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 119.224 -0.991 . . . . 2.0800000000000001 109.838 176.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 36.1 mm -55.05 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.794 0.664 . . . . 1.5 112.794 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 548' ' ' VAL . . . . . 0.621 HG22 HD11 ' B' ' 555' ' ' LEU . 9.3 p -47.36 -44.21 8.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 C-N-CA 119.77 -0.772 . . . . 1.3999999999999999 111.488 176.245 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.05 58.85 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.845 -0.534 . . . . 0.0 112.908 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 550' ' ' GLN . . . . . 0.459 ' C ' ' HD3' ' B' ' 552' ' ' PRO . 16.1 mm100 -87.06 -9.56 55.14 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.617 0.599 . . . . 2.27 112.617 -175.331 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -120.39 59.67 7.01 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.807 1.04 . . . . 3.5299999999999998 113.807 -177.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 552' ' ' PRO . . . . . 0.459 ' HD3' ' C ' ' B' ' 550' ' ' GLN . 34.4 Cg_exo -55.98 -39.34 91.81 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.068 0.509 . . . . 0.46000000000000002 113.152 177.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -56.3 -46.65 79.72 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 121.164 0.507 . . . . 3.8700000000000001 109.997 -174.206 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -49.02 -59.64 3.45 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 123.931 0.892 . . . . 0.69999999999999996 112.158 167.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 555' ' ' LEU . . . . . 0.621 HD11 HG22 ' B' ' 548' ' ' VAL . 82.2 mt -54.41 -48.51 71.53 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 116.271 -0.422 . . . . 1.49 110.195 -179.003 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 556' ' ' ARG . . . . . 0.547 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 56.0 ttt180 -53.98 -35.82 62.24 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.833 1.049 . . . . 3.0899999999999999 113.833 -178.276 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.05 -12.18 50.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.538 -0.465 . . . . 0.0 112.106 -177.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 51.0 m-70 -128.21 78.51 1.84 Allowed 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.393 1.257 . . . . 2.9300000000000002 114.393 -177.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 5.6 m-90 -50.63 -48.22 58.15 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.492 2.034 . . . . 3.1099999999999999 116.492 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -56.68 -36.56 69.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.423 . . . . 3.3199999999999998 111.152 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 561' ' ' PHE . . . . . 0.516 ' O ' HG23 ' B' ' 565' ' ' VAL . 1.4 t80 -74.92 -45.12 44.7 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.126 -1.03 . . . . 1.25 111.882 175.588 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 562' ' ' LEU . . . . . 0.638 HD12 HD11 ' B' ' 591' ' ' ILE . 26.2 tp -50.01 -59.09 4.22 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 122.44 0.296 . . . . 1.3200000000000001 110.314 175.095 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -50.24 -38.63 41.57 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.864 1.061 . . . . 2.7400000000000002 113.864 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 89.9 m -71.73 -39.42 70.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.583 0.706 . . . . 1.24 110.413 -176.119 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 565' ' ' VAL . . . . . 0.516 HG23 ' O ' ' B' ' 561' ' ' PHE . 59.3 t -62.81 -41.34 92.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 115.667 -0.697 . . . . 1.1899999999999999 112.529 173.394 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 566' ' ' VAL . . . . . 0.479 HG23 ' O ' ' B' ' 562' ' ' LEU . 42.3 t -70.94 -50.82 40.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.49 -0.484 . . . . 1.3600000000000001 110.873 -176.575 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -51.1 -37.48 46.12 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.075 -0.512 . . . . 1.9399999999999999 111.978 170.559 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 568' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' B' ' 568' ' ' LYS . 25.5 mmtp -72.55 -32.73 66.31 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.723 -0.473 . . . . 3.5299999999999998 109.723 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 569' ' ' LEU . . . . . 0.429 ' O ' ' HG3' ' B' ' 573' ' ' MET . 57.1 mt -67.52 -36.43 81.02 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 108.66 -0.867 . . . . 2.0099999999999998 108.66 177.123 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 570' ' ' PHE . . . . . 0.426 ' CE2' HG12 ' B' ' 566' ' ' VAL . 16.2 m-85 -65.4 -39.38 92.11 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.859 -0.423 . . . . 3.77 109.859 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -57.69 -53.53 57.13 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.881 -0.727 . . . . 2.4700000000000002 110.483 176.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -62.39 -9.89 9.7 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.158 1.17 . . . . 1.23 114.158 -177.206 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 573' ' ' MET . . . . . 0.82 ' HB3' HD11 ' B' ' 625' ' ' LEU . 26.5 mtm -76.42 -5.29 46.69 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.671 0.748 . . . . 2.1099999999999999 109.667 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -109.49 -0.59 18.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.765 -1.107 . . . . 3.2000000000000002 111.395 173.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 575' ' ' GLU . . . . . 0.462 ' HG2' HG11 ' B' ' 580' ' ' VAL . 18.6 tp10 -68.46 130.26 42.36 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.233 -0.44 . . . . 1.55 110.188 177.451 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 10.2 t -87.88 -21.34 25.04 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 112.947 0.721 . . . . 1.3999999999999999 112.947 -177.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -60.17 128.01 34.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.48 0.657 . . . . 2.8500000000000001 112.516 -175.31 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -44.81 125.83 5.28 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.391 -0.822 . . . . 2.1499999999999999 113.095 -171.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.62 4.83 Favored Glycine 0 C--O 1.223 -0.57 0 N-CA-C 116.294 1.278 . . . . 0.0 116.294 174.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 580' ' ' VAL . . . . . 0.462 HG11 ' HG2' ' B' ' 575' ' ' GLU . 43.1 t -53.88 -46.35 63.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 113.057 0.762 . . . . 1.29 113.057 -175.477 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.64 -42.25 92.34 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.409 0.522 . . . . 1.99 112.409 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -60.54 -42.45 96.54 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.159 0.429 . . . . 2.23 112.159 172.116 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 583' ' ' MET . . . . . 0.454 ' HG2' ' HA ' ' B' ' 542' ' ' SER . 3.1 tpt -60.7 -49.53 77.15 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 121.058 -0.257 . . . . 2.5800000000000001 110.416 175.543 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.89 80.29 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.181 -0.463 . . . . 0.029999999999999999 111.744 -177.13 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 81.2 m -74.44 -40.92 61.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 119.976 -0.69 . . . . 1.5 111.938 -177.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 586' ' ' ASP . . . . . 0.639 ' O ' HG22 ' B' ' 589' ' ' ILE . 2.0 m-20 -59.6 -46.32 89.3 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.273 -0.421 . . . . 1.98 111.974 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 87.2 m -62.16 -41.22 98.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.3 110.43 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 588' ' ' PHE . . . . . 0.587 ' O ' HG22 ' B' ' 591' ' ' ILE . 87.8 t80 -61.4 -32.22 72.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.047 -0.524 . . . . 0.53000000000000003 111.232 -177.685 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 589' ' ' ILE . . . . . 0.639 HG22 ' O ' ' B' ' 586' ' ' ASP . 9.7 tp -79.91 -35.99 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.871 -1.932 . . . . 1.97 109.74 -175.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -57.41 -50.04 74.3 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 107.752 -1.203 . . . . 2.6200000000000001 107.752 176.1 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 591' ' ' ILE . . . . . 0.638 HD11 HD12 ' B' ' 562' ' ' LEU . 12.2 tt -63.75 -43.72 98.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 112.885 0.698 . . . . 1.96 112.885 -177.062 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.94 -39.12 93.42 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.407 -0.517 . . . . 0.0 112.275 177.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -62.32 -70.08 0.22 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 119.113 -1.035 . . . . 2.3599999999999999 109.848 174.467 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 594' ' ' LYS . . . . . 0.478 ' HD2' ' N ' ' B' ' 594' ' ' LYS . 13.5 mptt -56.15 -23.76 36.82 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 116.56 2.059 . . . . 2.1899999999999999 116.56 -176.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.1 p -121.76 25.29 9.31 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.222 1.193 . . . . 1.26 114.222 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -48.61 -38.45 20.92 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.838 1.792 . . . . 3.5800000000000001 115.838 -172.429 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 597' ' ' ARG . . . . . 0.407 ' O ' HG22 ' B' ' 600' ' ' VAL . 38.7 mmt180 -69.56 -32.61 71.5 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.202 0.816 . . . . 3.7400000000000002 113.202 -175.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 598' ' ' HIS . . . . . 0.547 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 89.4 m-70 -70.21 -3.81 18.68 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.588 -0.733 . . . . 2.1400000000000001 112.052 -173.552 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 599' ' ' PHE . . . . . 0.518 ' O ' HG23 ' B' ' 611' ' ' ILE . 8.7 m-85 -105.64 -16.81 14.59 Favored 'General case' 0 CA--C 1.517 -0.301 0 O-C-N 123.621 0.576 . . . . 2.9500000000000002 110.204 -176.552 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 600' ' ' VAL . . . . . 0.455 HG12 HD13 ' B' ' 611' ' ' ILE . 34.5 m -105.85 -24.37 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 115.084 -0.962 . . . . 1.4199999999999999 111.355 -175.702 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -102.0 139.46 37.6 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 119.504 -0.879 . . . . 2.3399999999999999 111.661 176.401 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 4.8 p -60.86 122.81 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 N-CA-C 108.639 -0.874 . . . . 1.3700000000000001 108.639 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -92.88 167.33 11.91 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 123.645 0.591 . . . . 2.6800000000000002 110.049 -177.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 30.8 t -71.91 128.81 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 113.022 0.749 . . . . 1.27 113.022 -175.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.46 6.57 64.2 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.062 -175.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 606' ' ' GLU . . . . . 0.569 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.0 tp10 -131.45 158.08 41.79 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.626 -0.83 . . . . 2.5099999999999998 110.772 175.579 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 40.3 t -103.34 -22.57 4.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.04 -0.982 . . . . 1.3999999999999999 112.527 -175.19 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 608' ' ' MET . . . . . 0.569 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 22.7 ptp -136.92 142.25 37.88 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.611 0.597 . . . . 2.6800000000000002 112.611 -174.255 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.11 130.9 37.05 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.889 1.06 . . . . 0.42999999999999999 112.085 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 610' ' ' PHE . . . . . 0.434 ' CE2' HD11 ' B' ' 614' ' ' ILE . 16.4 t80 -57.04 -31.8 65.54 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.794 0.294 . . . . 2.3700000000000001 111.794 -174.141 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 611' ' ' ILE . . . . . 0.518 HG23 ' O ' ' B' ' 599' ' ' PHE . 8.9 pt -50.14 -44.71 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 120.811 0.339 . . . . 1.8400000000000001 110.591 178.244 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -49.93 -52.05 36.32 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.666 0.786 . . . . 2.1499999999999999 112.844 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 613' ' ' GLU . . . . . 0.475 ' O ' ' ND2' ' B' ' 617' ' ' ASN . 42.8 mt-10 -59.91 -37.09 78.45 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.562 -0.455 . . . . 2.6600000000000001 110.241 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 614' ' ' ILE . . . . . 0.434 HD11 ' CE2' ' B' ' 610' ' ' PHE . 24.5 mm -64.51 -47.97 86.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.934 0 C-N-CA 120.118 -0.633 . . . . 1.76 112.013 178.611 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 9.9 tt -62.69 -31.08 71.92 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.978 0.733 . . . . 1.8400000000000001 112.978 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -79.54 2.12 23.36 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.621 1.341 . . . . 2.0600000000000001 114.621 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 617' ' ' ASN . . . . . 0.475 ' ND2' ' O ' ' B' ' 613' ' ' GLU . 29.7 p30 -142.44 15.68 2.02 Favored 'General case' 0 C--O 1.242 0.685 0 N-CA-C 113.138 0.792 . . . . 1.97 113.138 -174.235 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 618' ' ' ILE . . . . . 0.494 ' O ' HG12 ' B' ' 621' ' ' ILE . 10.5 tt -46.97 -46.99 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 C-N-CA 118.921 -1.112 . . . . 2.0099999999999998 110.17 -176.682 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 619' ' ' ASN . . . . . 0.455 ' N ' HG23 ' B' ' 618' ' ' ILE . 78.2 m-20 -63.2 -51.05 67.88 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 113.785 1.031 . . . . 2.2799999999999998 113.785 -176.377 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 48.5 p -56.97 -31.83 65.42 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 119.432 -0.907 . . . . 1.3200000000000001 110.708 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 621' ' ' ILE . . . . . 0.494 HG12 ' O ' ' B' ' 618' ' ' ILE . 27.7 pt -79.3 -42.68 23.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.282 1.586 . . . . 2.0 115.282 -178.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 622' ' ' ILE . . . . . 0.708 ' HA ' HD13 ' B' ' 625' ' ' LEU . 2.8 pp -87.72 -6.21 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 115.035 1.494 . . . . 2.0899999999999999 115.035 -177.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 18.9 p -20.03 -58.34 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 116.493 2.035 . . . . 1.47 116.493 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.23 -7.58 26.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.011 -1.45 . . . . 2.0699999999999998 111.022 -163.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 625' ' ' LEU . . . . . 0.82 HD11 ' HB3' ' B' ' 573' ' ' MET . 9.1 mp -71.83 146.9 47.69 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 123.3 0.375 . . . . 1.6699999999999999 111.662 -173.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 626' ' ' GLN . . . . . 0.433 ' O ' HG23 ' B' ' 630' ' ' VAL . 1.8 mp0 -76.85 162.1 71.45 Favored Pre-proline 0 N--CA 1.464 0.254 0 N-CA-C 108.794 -0.817 . . . . 2.3500000000000001 108.794 174.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -47.78 -43.67 28.48 Favored 'Trans proline' 0 C--O 1.233 0.256 0 N-CA-C 115.799 1.423 . . . . 0.44 115.799 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -67.24 -43.03 82.97 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.423 -0.511 . . . . 2.6200000000000001 109.66 -174.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -63.27 -38.34 90.78 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 115.98 -0.555 . . . . 2.0600000000000001 110.923 178.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 630' ' ' VAL . . . . . 0.433 HG23 ' O ' ' B' ' 626' ' ' GLN . 97.8 t . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.163 -0.922 . . . . 1.3 110.722 176.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 504' ' ' ILE . . . . . 0.436 ' N ' HD13 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.236 0.386 0 N-CA-C 113.063 0.764 . . . . 2.1299999999999999 113.063 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 505' ' ' SER . . . . . 0.464 ' HB3' ' HG3' ' B' ' 550' ' ' GLN . 79.8 p -48.85 119.11 2.95 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.549 0.574 . . . . 1.29 112.549 174.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.88 1.43 67.69 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.964 -0.636 . . . . 0.0 114.407 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.55 41.43 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.646 0.723 . . . . 0.02 112.443 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 54.6 mtt -112.42 160.01 18.16 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 112.32 0.489 . . . . 2.21 112.32 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -69.78 134.21 48.3 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.131 -0.692 . . . . 2.6699999999999999 109.131 174.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -41.72 -35.44 0.79 Allowed 'General case' 0 C--O 1.241 0.623 0 N-CA-C 113.361 0.874 . . . . 2.6600000000000001 113.361 -173.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -73.67 -41.98 61.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.546 -0.752 . . . . 2.4399999999999999 112.152 -176.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -64.83 -40.11 94.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.145 0.498 . . . . 2.0800000000000001 110.885 171.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 513' ' ' GLU . . . . . 0.524 ' HG3' HD23 ' B' ' 517' ' ' LEU . 9.1 tp10 -53.71 -48.66 69.36 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.365 -0.834 . . . . 1.9199999999999999 111.108 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 514' ' ' LYS . . . . . 0.528 ' O ' ' HG ' ' B' ' 517' ' ' LEU . 62.9 mttp -54.81 -57.57 11.05 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 111.918 0.34 . . . . 2.73 111.918 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 515' ' ' ARG . . . . . 0.442 ' O ' HG12 ' B' ' 518' ' ' VAL . 39.8 ttm180 -56.61 -36.0 68.93 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 124.201 0.938 . . . . 3.75 111.092 -177.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.506 ' O ' HG23 ' B' ' 520' ' ' VAL . 88.8 t80 -76.02 -45.64 33.45 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.06 -0.973 . . . . 1.8899999999999999 110.554 -173.375 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 517' ' ' LEU . . . . . 0.566 HD12 ' N ' ' B' ' 518' ' ' VAL . 4.4 pp -66.63 -32.26 73.47 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.708 -0.678 . . . . 1.8999999999999999 112.674 177.087 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 518' ' ' VAL . . . . . 0.566 ' N ' HD12 ' B' ' 517' ' ' LEU . 7.7 p -67.53 -35.09 72.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 118.483 -1.287 . . . . 1.3999999999999999 109.047 178.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 60.8 p -73.01 -36.33 66.99 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.1799999999999999 112.391 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 520' ' ' VAL . . . . . 0.506 HG23 ' O ' ' B' ' 516' ' ' PHE . 56.0 t -71.23 -42.37 75.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.46 -0.336 . . . . 1.22 111.611 -174.421 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 521' ' ' ILE . . . . . 0.52 HG22 ' O ' ' B' ' 517' ' ' LEU . 14.5 tt -90.64 -25.75 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.492 1.664 . . . . 1.98 115.492 -175.116 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -60.83 -35.28 76.15 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.683 -0.858 . . . . 2.5699999999999998 108.683 173.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -92.36 -21.5 20.21 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.02 1.489 . . . . 2.1699999999999999 115.02 -177.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 524' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' B' ' 520' ' ' VAL . 84.2 mt -70.58 -45.46 65.34 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 109.28 -0.637 . . . . 1.48 109.28 168.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 84.6 mt -52.18 -45.46 65.15 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-O 121.329 0.585 . . . . 1.95 110.97 169.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 526' ' ' GLY . . . . . 0.426 ' O ' ' HG2' ' B' ' 529' ' ' GLU . . . -66.5 -40.59 94.34 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 -178.529 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 67.2 mt -63.57 -36.07 82.6 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 1.6699999999999999 111.47 175.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 47.6 t -63.55 -47.73 80.37 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.08 -0.509 . . . . 0.58999999999999997 110.661 -175.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 529' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' B' ' 526' ' ' GLY . 11.1 pt-20 -61.71 -29.59 70.2 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.508 -0.769 . . . . 2.5 112.589 173.796 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -71.61 -54.84 9.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.322 0.86 . . . . 2.2400000000000002 113.322 -177.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 531' ' ' LYS . . . . . 0.465 ' O ' ' HD3' ' B' ' 537' ' ' LYS . 31.6 mmmt -68.71 137.87 54.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.994 -0.548 . . . . 2.2799999999999998 111.047 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 19.1 ptt180 -96.37 160.67 14.29 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.79 -0.641 . . . . 4.21 110.149 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.39 119.58 1.34 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.841 -0.618 . . . . 0.0 114.008 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -47.06 -36.63 8.32 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.248 0.832 . . . . 2.9500000000000002 113.248 177.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -50.53 -51.89 43.68 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.397 -0.521 . . . . 2.2000000000000002 110.824 174.539 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 536' ' ' ASN . . . . . 0.424 ' O ' ' CG1' ' B' ' 539' ' ' ILE . 32.0 m-80 -65.98 -44.86 83.64 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.697 0.628 . . . . 1.47 112.697 178.265 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 537' ' ' LYS . . . . . 0.465 ' HD3' ' O ' ' B' ' 531' ' ' LYS . 5.3 mmmm -67.84 -32.02 72.26 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.263 -174.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.03 -47.04 69.52 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 115.889 -0.596 . . . . 0.040000000000000001 111.156 178.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 539' ' ' ILE . . . . . 0.47 HG13 ' N ' ' B' ' 540' ' ' ILE . 43.5 pt -58.15 -54.93 25.79 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 1.8200000000000001 111.224 173.446 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 540' ' ' ILE . . . . . 0.47 ' N ' HG13 ' B' ' 539' ' ' ILE . 87.1 mt -56.85 -48.09 81.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 121.7 -0.625 . . . . 1.8500000000000001 110.57 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 541' ' ' ALA . . . . . 0.475 ' O ' HG12 ' B' ' 544' ' ' ILE . . . -57.35 -44.17 84.1 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 113.678 0.992 . . . . 0.02 113.678 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 95.8 p -60.33 -38.83 84.97 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 120.658 -0.417 . . . . 1.2 110.294 -178.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -69.0 -47.12 66.28 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.339 1.237 . . . . 2.0299999999999998 114.339 -175.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 544' ' ' ILE . . . . . 0.53 HG13 ' N ' ' B' ' 545' ' ' MET . 47.1 pt -52.69 -45.89 49.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.515 -0.921 . . . . 1.8100000000000001 108.515 170.075 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 545' ' ' MET . . . . . 0.818 ' HB3' HG21 ' B' ' 587' ' ' THR . 77.0 mtm -64.06 -42.34 97.04 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.761 -0.776 . . . . 2.6000000000000001 112.786 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -58.26 -48.82 79.23 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 119.279 -0.969 . . . . 2.0800000000000001 109.857 176.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 28.9 mm -55.04 -61.41 1.05 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 112.862 0.69 . . . . 1.5 112.862 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 548' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' B' ' 545' ' ' MET . 33.4 m -47.32 -44.18 8.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 C-N-CA 119.872 -0.731 . . . . 1.3999999999999999 111.498 176.169 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.53 -27.95 59.07 Favored Glycine 0 C--N 1.331 0.285 0 O-C-N 121.835 -0.541 . . . . 0.0 112.851 -177.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 550' ' ' GLN . . . . . 0.464 ' HG3' ' HB3' ' B' ' 505' ' ' SER . 21.8 tp60 -87.13 -9.52 55.09 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.613 0.598 . . . . 2.27 112.613 -175.346 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 551' ' ' TYR . . . . . 0.482 ' O ' HD23 ' B' ' 555' ' ' LEU . 74.3 m-85 -120.36 59.72 6.98 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.809 1.04 . . . . 3.5299999999999998 113.809 -177.024 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.01 -39.3 92.03 Favored 'Trans proline' 0 CA--C 1.53 0.298 0 O-C-N 122.127 0.54 . . . . 0.46000000000000002 113.143 177.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 15.5 ptp180 -56.35 -46.71 79.84 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 121.095 0.474 . . . . 3.8700000000000001 109.931 -174.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -48.89 -59.8 3.28 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 123.958 0.903 . . . . 0.69999999999999996 112.113 167.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 555' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' B' ' 562' ' ' LEU . 4.4 mm? -54.34 -48.51 71.33 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 116.242 -0.436 . . . . 1.49 110.236 -178.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 63.1 mtp180 -53.93 -35.79 62.09 Favored 'General case' 0 C--O 1.243 0.757 0 N-CA-C 113.828 1.047 . . . . 3.0899999999999999 113.828 -178.32 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.13 -12.14 50.74 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.486 -0.486 . . . . 0.0 112.058 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -128.27 78.51 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.399 1.259 . . . . 2.9300000000000002 114.399 -177.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 559' ' ' TRP . . . . . 0.504 ' O ' ' HG2' ' B' ' 563' ' ' LYS . 31.8 m-90 -50.46 -48.32 56.56 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 116.563 2.06 . . . . 3.1099999999999999 116.563 -176.088 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 560' ' ' LYS . . . . . 0.426 ' O ' HG23 ' B' ' 564' ' ' THR . 63.6 mttp -56.67 -36.6 69.77 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.314 -0.403 . . . . 3.3199999999999998 111.13 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 561' ' ' PHE . . . . . 0.458 ' O ' HG23 ' B' ' 565' ' ' VAL . 2.6 t80 -74.94 -45.08 44.83 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 119.087 -1.045 . . . . 1.25 111.847 175.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 562' ' ' LEU . . . . . 0.633 ' HA ' HD12 ' B' ' 555' ' ' LEU . 2.1 tt -50.0 -59.11 4.2 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.466 0.306 . . . . 1.3200000000000001 110.29 175.094 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 563' ' ' LYS . . . . . 0.527 ' O ' HG12 ' B' ' 566' ' ' VAL . 11.0 mmpt? -50.22 -38.67 41.48 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.863 1.061 . . . . 2.7400000000000002 113.863 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 564' ' ' THR . . . . . 0.426 HG23 ' O ' ' B' ' 560' ' ' LYS . 24.0 p -71.79 -39.33 69.98 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.495 0.664 . . . . 1.24 110.408 -176.107 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 565' ' ' VAL . . . . . 0.458 HG23 ' O ' ' B' ' 561' ' ' PHE . 97.9 t -62.83 -41.32 92.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.617 -0.72 . . . . 1.1899999999999999 112.502 173.367 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 566' ' ' VAL . . . . . 0.527 HG12 ' O ' ' B' ' 563' ' ' LYS . 11.5 p -71.06 -50.74 40.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 C-N-CA 120.451 -0.499 . . . . 1.3600000000000001 110.872 -176.476 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 567' ' ' ASN . . . . . 0.442 ' N ' HG13 ' B' ' 566' ' ' VAL . 6.7 t30 -51.13 -37.42 45.97 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.067 -0.515 . . . . 1.9399999999999999 112.006 170.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 568' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' B' ' 568' ' ' LYS . 0.3 OUTLIER -72.6 -32.7 66.17 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.746 -0.465 . . . . 3.5299999999999998 109.746 -179.234 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 569' ' ' LEU . . . . . 0.447 ' O ' ' HG3' ' B' ' 573' ' ' MET . 4.1 mp -67.43 -36.52 81.39 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.67 -0.863 . . . . 2.0099999999999998 108.67 177.103 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 570' ' ' PHE . . . . . 0.406 ' CE2' HG22 ' B' ' 566' ' ' VAL . 19.5 m-85 -65.38 -39.28 92.06 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.907 -0.405 . . . . 3.77 109.907 178.346 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.73 -53.47 57.79 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 119.921 -0.711 . . . . 2.4700000000000002 110.51 176.702 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -62.49 -9.92 10.11 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.056 1.132 . . . . 1.23 114.056 -177.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 573' ' ' MET . . . . . 0.878 ' HB3' HD11 ' B' ' 625' ' ' LEU . 67.7 mtt -76.42 -5.31 46.75 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.618 0.723 . . . . 2.1099999999999999 109.625 178.613 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 30.0 m-70 -109.42 -0.51 18.91 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.842 -1.072 . . . . 3.2000000000000002 111.502 173.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 575' ' ' GLU . . . . . 0.42 ' HG2' HG11 ' B' ' 580' ' ' VAL . 13.0 tp10 -68.55 130.26 42.35 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.15 -0.477 . . . . 1.55 110.137 177.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 81.8 p -87.89 -21.27 25.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 112.981 0.734 . . . . 1.3999999999999999 112.981 -177.167 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -60.2 128.01 34.67 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.411 0.624 . . . . 2.8500000000000001 112.578 -175.353 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -44.9 125.88 5.4 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.388 -0.824 . . . . 2.1499999999999999 113.103 -171.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.22 -34.64 4.82 Favored Glycine 0 C--O 1.223 -0.553 0 N-CA-C 116.242 1.257 . . . . 0.0 116.242 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 580' ' ' VAL . . . . . 0.42 HG11 ' HG2' ' B' ' 575' ' ' GLU . 93.9 t -53.81 -46.27 63.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.232 0.827 . . . . 1.29 113.232 -175.571 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -59.77 -42.18 92.76 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.361 0.504 . . . . 1.99 112.361 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -60.56 -42.39 96.5 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.209 0.448 . . . . 2.23 112.209 172.065 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 26.4 mmt -60.76 -49.46 77.42 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 121.043 -0.263 . . . . 2.5800000000000001 110.402 175.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.92 80.2 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.265 -0.425 . . . . 0.029999999999999999 111.783 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 585' ' ' CYS . . . . . 0.417 ' O ' HG13 ' B' ' 589' ' ' ILE . 28.8 p -74.39 -40.98 61.7 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 120.066 -0.654 . . . . 1.5 111.929 -177.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -59.56 -46.35 89.16 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.209 -0.45 . . . . 1.98 111.962 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 587' ' ' THR . . . . . 0.818 HG21 ' HB3' ' B' ' 545' ' ' MET . 29.3 p -62.19 -41.23 98.14 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.298 0.639 . . . . 1.3 110.42 175.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -61.4 -32.25 72.18 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.059 -0.519 . . . . 0.53000000000000003 111.177 -177.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 589' ' ' ILE . . . . . 0.417 HG13 ' O ' ' B' ' 585' ' ' CYS . 74.4 mt -79.81 -35.97 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 C-N-CA 116.91 -1.916 . . . . 1.97 109.831 -175.435 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -57.48 -49.99 74.49 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 107.717 -1.216 . . . . 2.6200000000000001 107.717 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 591' ' ' ILE . . . . . 0.42 HG12 ' O ' ' B' ' 587' ' ' THR . 49.0 mm -63.86 -43.71 97.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.697 -0.683 . . . . 1.96 112.779 -176.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.96 -39.13 93.44 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.512 -0.475 . . . . 0.0 112.252 177.633 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -62.34 -70.12 0.22 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 119.129 -1.029 . . . . 2.3599999999999999 109.825 174.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -56.19 -23.65 36.62 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 116.617 2.08 . . . . 2.1899999999999999 116.617 -176.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.4 p -121.79 25.29 9.29 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.189 1.181 . . . . 1.26 114.189 -178.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -48.54 -38.58 20.84 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 115.841 1.793 . . . . 3.5800000000000001 115.841 -172.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 597' ' ' ARG . . . . . 0.427 ' O ' HG22 ' B' ' 600' ' ' VAL . 96.8 mtt180 -69.47 -32.64 71.68 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.302 0.852 . . . . 3.7400000000000002 113.302 -175.584 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -70.19 -3.78 18.48 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.523 -0.762 . . . . 2.1400000000000001 112.032 -173.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -105.6 -16.87 14.58 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.633 0.583 . . . . 2.9500000000000002 110.197 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 600' ' ' VAL . . . . . 0.427 HG22 ' O ' ' B' ' 597' ' ' ARG . 33.2 m -105.82 -24.39 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.037 -0.983 . . . . 1.4199999999999999 111.327 -175.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 601' ' ' GLN . . . . . 0.417 ' HG2' HG23 ' B' ' 600' ' ' VAL . 14.2 mm100 -101.98 139.49 37.54 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.535 -0.866 . . . . 2.3399999999999999 111.635 176.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 43.9 t -60.87 122.76 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 108.561 -0.903 . . . . 1.3700000000000001 108.561 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 603' ' ' GLN . . . . . 0.476 ' NE2' ' HB3' ' B' ' 559' ' ' TRP . 4.0 pt20 -92.8 167.33 11.93 Favored 'General case' 0 C--O 1.224 -0.263 0 O-C-N 123.673 0.608 . . . . 2.6800000000000002 110.116 -177.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 15.6 m -72.0 128.97 35.51 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 N-CA-C 112.98 0.733 . . . . 1.27 112.98 -175.249 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.33 6.57 64.43 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.11 -175.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 606' ' ' GLU . . . . . 0.572 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.3 tp10 -131.48 158.06 41.88 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.641 -0.824 . . . . 2.5099999999999998 110.757 175.56 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 5.3 t -103.32 -22.58 4.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.036 -0.984 . . . . 1.3999999999999999 112.472 -175.124 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 608' ' ' MET . . . . . 0.572 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 20.0 ptm -136.97 142.1 37.22 Favored Pre-proline 0 C--O 1.223 -0.297 0 N-CA-C 112.712 0.634 . . . . 2.6800000000000002 112.712 -174.254 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 609' ' ' PRO . . . . . 0.536 ' HB2' HG22 ' B' ' 611' ' ' ILE . 9.6 Cg_endo -51.91 130.8 35.92 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 120.902 1.068 . . . . 0.42999999999999999 112.202 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -57.0 -31.74 65.39 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.794 0.294 . . . . 2.3700000000000001 111.794 -174.103 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 611' ' ' ILE . . . . . 0.536 HG22 ' HB2' ' B' ' 609' ' ' PRO . 12.2 tt -50.16 -44.74 23.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 CA-C-O 120.782 0.325 . . . . 1.8400000000000001 110.493 178.287 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 612' ' ' ASP . . . . . 0.415 ' OD1' ' HG2' ' B' ' 609' ' ' PRO . 1.0 OUTLIER -50.04 -51.99 37.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.587 0.755 . . . . 2.1499999999999999 112.849 177.72 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -59.88 -37.1 78.41 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.604 -0.438 . . . . 2.6600000000000001 110.21 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 614' ' ' ILE . . . . . 0.439 ' O ' ' ND2' ' B' ' 617' ' ' ASN . 67.5 mt -64.6 -47.93 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 120.233 -0.587 . . . . 1.76 111.963 178.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 51.7 tp -62.66 -31.19 72.01 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.946 0.721 . . . . 1.8400000000000001 112.946 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -79.47 2.12 23.14 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.632 1.345 . . . . 2.0600000000000001 114.632 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 617' ' ' ASN . . . . . 0.46 ' ND2' ' C ' ' B' ' 617' ' ' ASN . 0.0 OUTLIER -142.47 15.79 2.01 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 113.141 0.793 . . . . 1.97 113.141 -174.248 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 618' ' ' ILE . . . . . 0.489 HG13 ' N ' ' B' ' 619' ' ' ASN . 19.7 pt -46.99 -47.06 8.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 C-N-CA 118.949 -1.1 . . . . 2.0099999999999998 110.139 -176.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 619' ' ' ASN . . . . . 0.489 ' N ' HG13 ' B' ' 618' ' ' ILE . 6.3 p30 -63.21 -51.05 67.85 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.769 1.026 . . . . 2.2799999999999998 113.769 -176.355 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 62.9 p -56.89 -31.86 65.29 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 119.539 -0.864 . . . . 1.3200000000000001 110.774 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 621' ' ' ILE . . . . . 0.475 HG13 HG23 ' B' ' 622' ' ' ILE . 49.2 pt -79.36 -42.6 23.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 115.385 1.624 . . . . 2.0 115.385 -179.008 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 622' ' ' ILE . . . . . 0.72 ' HA ' HD13 ' B' ' 625' ' ' LEU . 43.5 pt -87.74 -6.24 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 115.005 1.483 . . . . 2.0899999999999999 115.005 -177.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 66.8 m -19.91 -58.38 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.543 2.053 . . . . 1.47 116.543 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -99.27 -7.63 26.13 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.983 -1.462 . . . . 2.0699999999999998 111.022 -163.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 625' ' ' LEU . . . . . 0.878 HD11 ' HB3' ' B' ' 573' ' ' MET . 8.8 mp -71.84 146.93 47.64 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 123.289 0.368 . . . . 1.6699999999999999 111.687 -173.642 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 626' ' ' GLN . . . . . 0.531 ' HB3' ' HD2' ' B' ' 627' ' ' PRO . 49.2 mt-30 -76.84 162.1 71.47 Favored Pre-proline 0 CA--C 1.518 -0.262 0 N-CA-C 108.818 -0.808 . . . . 2.3500000000000001 108.818 174.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 627' ' ' PRO . . . . . 0.531 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 6.1 Cg_endo -47.84 -43.62 28.91 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.813 1.428 . . . . 0.44 115.813 -178.385 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 27.7 mp0 -67.28 -43.03 82.78 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.396 -0.522 . . . . 2.6200000000000001 109.602 -174.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 21.4 mm-40 -63.25 -38.3 90.61 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.968 -0.56 . . . . 2.0600000000000001 110.92 178.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 630' ' ' VAL . . . . . 0.425 HG23 ' O ' ' B' ' 626' ' ' GLN . 93.5 t . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.22 -0.895 . . . . 1.3 110.644 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 504' ' ' ILE . . . . . 0.494 ' N ' HD13 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.291 0 N-CA-C 113.112 0.782 . . . . 2.1299999999999999 113.112 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 77.9 p -48.89 119.2 3.02 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.548 0.573 . . . . 1.29 112.548 174.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.78 1.51 67.89 Favored Glycine 0 CA--C 1.526 0.741 0 C-N-CA 120.948 -0.644 . . . . 0.0 114.468 -179.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.52 41.51 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.653 0.727 . . . . 0.02 112.456 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -112.5 160.02 18.2 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 121.196 0.522 . . . . 2.21 112.214 174.159 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -69.78 134.19 48.29 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.056 -0.72 . . . . 2.6699999999999999 109.056 174.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 510' ' ' GLU . . . . . 0.485 ' O ' ' HG3' ' B' ' 514' ' ' LYS . 38.7 mt-10 -41.62 -35.33 0.73 Allowed 'General case' 0 C--O 1.24 0.565 0 N-CA-C 113.498 0.925 . . . . 2.6600000000000001 113.498 -173.301 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -73.87 -41.94 61.49 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.485 -0.78 . . . . 2.4399999999999999 112.086 -176.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -64.93 -40.03 94.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.133 0.492 . . . . 2.0800000000000001 110.862 171.24 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 513' ' ' GLU . . . . . 0.438 ' O ' HD23 ' B' ' 517' ' ' LEU . 43.6 mt-10 -53.77 -48.55 69.65 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.344 -0.843 . . . . 1.9199999999999999 111.155 177.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 514' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' B' ' 510' ' ' GLU . 67.1 mttm -54.92 -57.62 10.92 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 116.476 -0.329 . . . . 2.73 111.852 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 515' ' ' ARG . . . . . 0.494 ' O ' HG22 ' B' ' 518' ' ' VAL . 5.8 tmm_? -56.59 -35.97 68.84 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.173 0.921 . . . . 3.75 111.086 -177.478 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -76.06 -45.59 33.42 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.118 -0.947 . . . . 1.8899999999999999 110.535 -173.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 517' ' ' LEU . . . . . 0.618 ' O ' HG22 ' B' ' 521' ' ' ILE . 4.5 mm? -66.75 -32.23 73.39 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.742 -0.663 . . . . 1.8999999999999999 112.627 177.137 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 518' ' ' VAL . . . . . 0.494 HG22 ' O ' ' B' ' 515' ' ' ARG . 35.9 m -67.48 -35.17 72.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 118.535 -1.266 . . . . 1.3999999999999999 109.034 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 42.2 m -72.89 -36.42 67.33 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.428 0.633 . . . . 1.1799999999999999 112.42 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 520' ' ' VAL . . . . . 0.57 HG12 ' HA ' ' B' ' 517' ' ' LEU . 7.1 p -71.19 -42.32 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 O-C-N 122.115 -0.366 . . . . 1.22 111.663 -174.4 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 521' ' ' ILE . . . . . 0.618 HG22 ' O ' ' B' ' 517' ' ' LEU . 14.3 tt -90.71 -25.7 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.473 1.657 . . . . 1.98 115.473 -175.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 6.1 tmmm? -60.86 -35.24 76.09 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.666 -0.864 . . . . 2.5699999999999998 108.666 173.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -92.41 -21.54 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.008 1.484 . . . . 2.1699999999999999 115.008 -177.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 80.5 mt -70.52 -45.44 65.56 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.315 -0.624 . . . . 1.48 109.315 168.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 85.0 mt -52.23 -45.42 65.28 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-O 121.273 0.559 . . . . 1.95 110.971 169.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.56 -40.48 94.21 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 -178.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 66.3 mt -63.7 -36.08 82.67 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.021 0.439 . . . . 1.6699999999999999 111.382 175.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 40.7 t -63.47 -47.74 80.55 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.104 -0.498 . . . . 0.58999999999999997 110.706 -175.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.7 -29.64 70.23 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.446 -0.797 . . . . 2.5 112.578 173.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -71.58 -54.76 9.43 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 113.384 0.883 . . . . 2.2400000000000002 113.384 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -68.75 137.87 54.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.937 -0.574 . . . . 2.2799999999999998 111.047 -177.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 532' ' ' ARG . . . . . 0.605 ' HD3' ' HZ1' ' B' ' 537' ' ' LYS . 21.7 tpp180 -96.42 160.73 14.25 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.798 -0.637 . . . . 4.21 110.166 178.417 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.62 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.854 -0.612 . . . . 0.0 114.022 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -47.08 -36.66 8.46 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.196 0.813 . . . . 2.9500000000000002 113.196 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -50.51 -51.86 43.75 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 120.367 -0.533 . . . . 2.2000000000000002 110.857 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 536' ' ' ASN . . . . . 0.499 ' O ' HG22 ' B' ' 539' ' ' ILE . 0.2 OUTLIER -66.13 -44.78 83.23 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.603 0.594 . . . . 1.47 112.603 178.359 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 537' ' ' LYS . . . . . 0.605 ' HZ1' ' HD3' ' B' ' 532' ' ' ARG . 62.6 mttp -67.87 -31.94 72.09 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.272 -174.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.17 -46.96 69.29 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.886 -0.597 . . . . 0.040000000000000001 111.092 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 539' ' ' ILE . . . . . 0.499 HG22 ' O ' ' B' ' 536' ' ' ASN . 8.2 tp -58.22 -54.91 26.09 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 1.8200000000000001 111.247 173.455 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 540' ' ' ILE . . . . . 0.425 ' N ' HG23 ' B' ' 539' ' ' ILE . 48.4 mm -56.79 -48.06 81.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.607 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.51 -44.06 84.72 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 113.645 0.98 . . . . 0.02 113.645 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 94.9 p -60.35 -38.88 85.22 Favored 'General case' 0 C--O 1.22 -0.478 0 C-N-CA 120.6 -0.44 . . . . 1.2 110.3 -178.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -68.95 -47.17 66.33 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 114.323 1.231 . . . . 2.0299999999999998 114.323 -175.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 544' ' ' ILE . . . . . 0.451 HG23 HG13 ' B' ' 521' ' ' ILE . 85.2 mt -52.55 -45.94 47.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.586 -0.894 . . . . 1.8100000000000001 108.586 169.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 545' ' ' MET . . . . . 0.453 ' HA ' HG12 ' B' ' 548' ' ' VAL . 74.2 mtm -64.03 -42.29 97.14 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.763 -0.775 . . . . 2.6000000000000001 112.818 179.4 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -58.34 -48.8 79.42 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 119.234 -0.986 . . . . 2.0800000000000001 109.838 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 95.0 mt -55.07 -61.41 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 112.846 0.684 . . . . 1.5 112.846 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 548' ' ' VAL . . . . . 0.633 HG23 HD21 ' B' ' 555' ' ' LEU . 10.5 p -47.36 -44.21 8.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.838 -0.745 . . . . 1.3999999999999999 111.442 176.213 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 549' ' ' GLY . . . . . 0.535 ' HA2' HD11 ' B' ' 591' ' ' ILE . . . -57.41 -28.08 58.9 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -87.01 -9.53 55.33 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 112.629 0.604 . . . . 2.27 112.629 -175.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 551' ' ' TYR . . . . . 0.543 ' O ' HD23 ' B' ' 555' ' ' LEU . 80.2 m-85 -120.46 59.66 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.796 1.035 . . . . 3.5299999999999998 113.796 -176.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 552' ' ' PRO . . . . . 0.549 ' HG3' ' HG2' ' B' ' 594' ' ' LYS . 13.3 Cg_endo -55.93 -39.43 91.19 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 O-C-N 122.087 0.52 . . . . 0.46000000000000002 113.114 177.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -56.26 -46.77 79.52 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 121.145 0.498 . . . . 3.8700000000000001 109.926 -174.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -48.98 -59.71 3.38 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 123.953 0.901 . . . . 0.69999999999999996 112.046 168.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 555' ' ' LEU . . . . . 0.633 HD21 HG23 ' B' ' 548' ' ' VAL . 4.3 mm? -54.3 -48.66 71.04 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 116.334 -0.394 . . . . 1.49 110.158 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 556' ' ' ARG . . . . . 0.571 ' HG3' ' HE2' ' B' ' 598' ' ' HIS . 21.3 ttm180 -53.87 -35.8 61.94 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.857 1.058 . . . . 3.0899999999999999 113.857 -178.255 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.1 -12.22 50.64 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.48 -0.488 . . . . 0.0 112.043 -177.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 70.9 m-70 -128.19 78.47 1.84 Allowed 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.404 1.261 . . . . 2.9300000000000002 114.404 -177.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 47.1 p90 -50.47 -48.28 56.71 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 116.59 2.07 . . . . 3.1099999999999999 116.59 -176.101 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 560' ' ' LYS . . . . . 0.426 ' O ' HG23 ' B' ' 564' ' ' THR . 63.5 tttm -56.7 -36.61 69.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 3.3199999999999998 111.099 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 561' ' ' PHE . . . . . 0.449 ' O ' HG23 ' B' ' 565' ' ' VAL . 1.7 t80 -74.91 -45.15 44.61 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 119.163 -1.015 . . . . 1.25 111.847 175.641 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 562' ' ' LEU . . . . . 0.595 ' HA ' HD12 ' B' ' 555' ' ' LEU . 5.5 tt -49.96 -59.18 4.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.498 0.319 . . . . 1.3200000000000001 110.229 175.093 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 563' ' ' LYS . . . . . 0.466 ' HA ' HG22 ' B' ' 566' ' ' VAL . 39.7 tttm -50.2 -38.63 40.92 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.831 1.049 . . . . 2.7400000000000002 113.831 178.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 564' ' ' THR . . . . . 0.426 HG23 ' O ' ' B' ' 560' ' ' LYS . 23.3 p -71.81 -39.36 69.89 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.5 0.667 . . . . 1.24 110.366 -176.065 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 565' ' ' VAL . . . . . 0.449 HG23 ' O ' ' B' ' 561' ' ' PHE . 99.6 t -62.88 -41.28 92.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.628 -0.714 . . . . 1.1899999999999999 112.49 173.415 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 566' ' ' VAL . . . . . 0.717 ' HA ' HD23 ' B' ' 569' ' ' LEU . 30.3 m -71.01 -50.9 39.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 C-N-CA 120.485 -0.486 . . . . 1.3600000000000001 110.793 -176.472 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 567' ' ' ASN . . . . . 0.426 ' N ' HG23 ' B' ' 566' ' ' VAL . 42.0 m-80 -51.07 -37.38 45.23 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 116.002 -0.545 . . . . 1.9399999999999999 112.007 170.595 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 568' ' ' LYS . . . . . 0.407 ' HE2' ' HB3' ' B' ' 568' ' ' LYS . 29.8 ttpt -72.64 -32.67 66.06 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.77 -0.456 . . . . 3.5299999999999998 109.77 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 569' ' ' LEU . . . . . 0.717 HD23 ' HA ' ' B' ' 566' ' ' VAL . 0.2 OUTLIER -67.5 -36.49 81.17 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.687 -0.857 . . . . 2.0099999999999998 108.687 177.058 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 570' ' ' PHE . . . . . 0.527 ' HD1' HG13 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.38 -39.27 92.05 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.907 -0.405 . . . . 3.77 109.907 178.346 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -57.74 -53.49 57.61 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.982 -0.687 . . . . 2.4700000000000002 110.47 176.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 572' ' ' PHE . . . . . 0.647 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 22.6 m-85 -62.45 -9.98 10.17 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.118 1.155 . . . . 1.23 114.118 -177.15 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 573' ' ' MET . . . . . 0.48 ' HB3' HD21 ' B' ' 625' ' ' LEU . 35.5 mtt -76.38 -5.26 46.44 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.641 0.734 . . . . 2.1099999999999999 109.651 178.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -109.44 -0.56 18.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.82 -1.082 . . . . 3.2000000000000002 111.411 173.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 575' ' ' GLU . . . . . 0.647 ' HG2' ' HA ' ' B' ' 572' ' ' PHE . 29.4 mm-40 -68.53 130.23 42.25 Favored 'General case' 0 C--O 1.233 0.221 0 O-C-N 123.422 0.451 . . . . 1.55 110.077 177.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 82.7 p -87.84 -21.36 25.07 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 113.011 0.745 . . . . 1.3999999999999999 113.011 -177.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -60.09 128.03 34.81 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.425 0.631 . . . . 2.8500000000000001 112.532 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -44.96 125.84 5.42 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.332 -0.849 . . . . 2.1499999999999999 113.119 -171.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.27 -34.69 4.8 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.219 1.247 . . . . 0.0 116.219 174.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 55.5 t -53.72 -46.42 62.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.13 0.789 . . . . 1.29 113.13 -175.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -59.57 -42.34 92.26 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.406 0.521 . . . . 1.99 112.406 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -60.53 -42.41 96.42 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 112.19 0.441 . . . . 2.23 112.19 172.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 6.9 tpt -60.7 -49.53 77.15 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 121.058 -0.257 . . . . 2.5800000000000001 110.416 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.79 -42.93 80.32 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.181 -0.463 . . . . 0.029999999999999999 111.692 -177.105 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 585' ' ' CYS . . . . . 0.423 ' O ' HG13 ' B' ' 589' ' ' ILE . 52.0 t -74.49 -40.87 61.55 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 119.976 -0.69 . . . . 1.5 111.91 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.54 -46.34 89.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.351 -0.386 . . . . 1.98 111.995 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 86.4 m -62.21 -41.22 98.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.3 110.381 175.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 588' ' ' PHE . . . . . 0.487 ' HB2' HD13 ' B' ' 569' ' ' LEU . 19.2 t80 -61.44 -32.23 72.2 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.089 -0.505 . . . . 0.53000000000000003 111.146 -177.611 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 589' ' ' ILE . . . . . 0.423 HG13 ' O ' ' B' ' 585' ' ' CYS . 68.8 mt -79.86 -35.99 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.008 0 C-N-CA 116.902 -1.919 . . . . 1.97 109.773 -175.39 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 590' ' ' LYS . . . . . 0.416 ' O ' ' HE3' ' B' ' 594' ' ' LYS . 67.8 mttm -57.47 -50.04 74.32 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 107.717 -1.216 . . . . 2.6200000000000001 107.717 176.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 591' ' ' ILE . . . . . 0.535 HD11 ' HA2' ' B' ' 549' ' ' GLY . 1.7 mp -63.77 -43.74 98.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.693 -0.685 . . . . 1.96 112.815 -177.021 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.95 -39.12 93.41 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.443 -0.503 . . . . 0.0 112.275 177.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -62.37 -70.02 0.22 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 119.096 -1.041 . . . . 2.3599999999999999 109.834 174.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 594' ' ' LYS . . . . . 0.549 ' HG2' ' HG3' ' B' ' 552' ' ' PRO . 0.0 OUTLIER -56.14 -23.8 36.91 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 116.655 2.095 . . . . 2.1899999999999999 116.655 -176.565 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 83.8 m -121.63 25.21 9.42 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.243 1.201 . . . . 1.26 114.243 -178.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -48.59 -38.49 20.9 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.792 1.775 . . . . 3.5800000000000001 115.792 -172.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 597' ' ' ARG . . . . . 0.425 ' O ' ' HG2' ' B' ' 601' ' ' GLN . 38.5 mmt180 -69.52 -32.69 71.69 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.202 0.816 . . . . 3.7400000000000002 113.202 -175.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 598' ' ' HIS . . . . . 0.571 ' HE2' ' HG3' ' B' ' 556' ' ' ARG . 31.3 m80 -70.13 -3.82 18.49 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.662 -0.699 . . . . 2.1400000000000001 112.053 -173.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 599' ' ' PHE . . . . . 0.544 ' O ' HG23 ' B' ' 611' ' ' ILE . 74.8 m-85 -105.52 -16.94 14.57 Favored 'General case' 0 CA--C 1.517 -0.295 0 O-C-N 123.669 0.606 . . . . 2.9500000000000002 110.279 -176.575 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 10.0 p -105.81 -24.36 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.031 -0.986 . . . . 1.4199999999999999 111.311 -175.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 601' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 30.3 pt20 -102.02 139.5 37.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.578 -0.849 . . . . 2.3399999999999999 111.569 176.438 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 6.6 m -60.91 122.71 12.1 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.441 0 N-CA-C 108.599 -0.889 . . . . 1.3700000000000001 108.599 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 603' ' ' GLN . . . . . 0.429 ' HB2' ' HE1' ' B' ' 610' ' ' PHE . 13.7 mm100 -92.78 167.31 11.95 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 123.729 0.643 . . . . 2.6800000000000002 110.048 -177.553 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 62.1 t -71.98 128.99 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 113.018 0.748 . . . . 1.27 113.018 -175.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.4 6.5 64.38 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.039 -175.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -131.5 158.08 41.83 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.651 -0.82 . . . . 2.5099999999999998 110.788 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 607' ' ' VAL . . . . . 0.608 HG23 ' HG2' ' B' ' 608' ' ' MET . 19.0 m -103.29 -22.59 4.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.023 -0.989 . . . . 1.3999999999999999 112.447 -175.077 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 608' ' ' MET . . . . . 0.608 ' HG2' HG23 ' B' ' 607' ' ' VAL . 94.1 mmm -136.99 142.22 37.62 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 112.649 0.611 . . . . 2.6800000000000002 112.649 -174.203 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -52.07 130.84 36.65 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 120.899 1.066 . . . . 0.42999999999999999 112.165 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 610' ' ' PHE . . . . . 0.464 ' H ' ' HD1' ' B' ' 610' ' ' PHE . 7.8 m-85 -56.96 -31.8 65.39 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 111.874 0.324 . . . . 2.3700000000000001 111.874 -174.102 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 611' ' ' ILE . . . . . 0.544 HG23 ' O ' ' B' ' 599' ' ' PHE . 10.3 pt -50.07 -44.79 22.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-O 120.726 0.298 . . . . 1.8400000000000001 110.548 178.173 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -50.01 -52.02 37.3 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.597 0.759 . . . . 2.1499999999999999 112.821 177.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -59.96 -37.05 78.47 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.535 -0.466 . . . . 2.6600000000000001 110.234 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 614' ' ' ILE . . . . . 0.412 HD12 ' HA ' ' B' ' 611' ' ' ILE . 60.5 mt -64.44 -48.1 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 120.246 -0.582 . . . . 1.76 111.925 178.601 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 55.0 tp -62.61 -31.17 71.96 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.955 0.724 . . . . 1.8400000000000001 112.955 -177.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -79.5 2.12 23.23 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.621 1.341 . . . . 2.0600000000000001 114.621 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 617' ' ' ASN . . . . . 0.434 ' O ' HG22 ' B' ' 621' ' ' ILE . 38.8 m-80 -142.44 15.67 2.01 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.168 0.803 . . . . 1.97 113.168 -174.245 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 618' ' ' ILE . . . . . 0.466 HG13 ' N ' ' B' ' 619' ' ' ASN . 20.9 pt -46.92 -47.06 8.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 C-N-CA 118.957 -1.097 . . . . 2.0099999999999998 110.127 -176.647 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 619' ' ' ASN . . . . . 0.466 ' N ' HG13 ' B' ' 618' ' ' ILE . 18.8 m120 -63.2 -51.05 67.89 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.787 1.032 . . . . 2.2799999999999998 113.787 -176.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 42.0 m -56.92 -31.83 65.33 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 119.455 -0.898 . . . . 1.3200000000000001 110.763 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 621' ' ' ILE . . . . . 0.527 HG13 ' HD1' ' B' ' 570' ' ' PHE . 15.0 tt -79.35 -42.61 23.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 115.355 1.613 . . . . 2.0 115.355 -179.021 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 622' ' ' ILE . . . . . 0.452 HG23 HG23 ' B' ' 621' ' ' ILE . 38.3 pt -87.73 -6.24 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 115.09 1.515 . . . . 2.0899999999999999 115.09 -177.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.7 t -19.9 -58.39 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 116.598 2.073 . . . . 1.47 116.598 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -99.21 -7.56 26.33 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 113.981 -1.463 . . . . 2.0699999999999998 111.056 -164.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 625' ' ' LEU . . . . . 0.48 HD21 ' HB3' ' B' ' 573' ' ' MET . 90.2 mt -71.9 146.91 47.54 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.264 0.352 . . . . 1.6699999999999999 111.654 -173.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 626' ' ' GLN . . . . . 0.451 ' O ' HG23 ' B' ' 630' ' ' VAL . 30.0 mm-40 -76.84 162.09 71.51 Favored Pre-proline 0 CA--C 1.519 -0.233 0 N-CA-C 108.773 -0.825 . . . . 2.3500000000000001 108.773 174.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -47.83 -43.61 28.88 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.813 1.428 . . . . 0.44 115.813 -178.385 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 21.7 tm0? -67.25 -43.01 82.97 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 120.423 -0.511 . . . . 2.6200000000000001 109.686 -174.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -63.35 -38.16 90.07 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.856 -0.611 . . . . 2.0600000000000001 110.904 178.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 630' ' ' VAL . . . . . 0.451 HG23 ' O ' ' B' ' 626' ' ' GLN . 67.2 t . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.33 -0.843 . . . . 1.3 110.687 176.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 35.0 pt . . . . . 0 C--O 1.235 0.291 0 N-CA-C 113.06 0.763 . . . . 2.1299999999999999 113.06 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 42.3 t -49.01 119.21 3.06 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.545 0.572 . . . . 1.29 112.545 174.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.79 1.5 67.87 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.995 -0.621 . . . . 0.0 114.418 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.31 -7.53 41.59 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.711 0.755 . . . . 0.02 112.443 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 508' ' ' MET . . . . . 0.426 ' HB2' ' HG2' ' B' ' 513' ' ' GLU . 24.6 mmt -112.46 159.96 18.23 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 121.123 0.487 . . . . 2.21 112.297 174.126 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -69.78 134.19 48.29 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.119 -0.697 . . . . 2.6699999999999999 109.119 174.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -41.67 -35.4 0.76 Allowed 'General case' 0 C--O 1.24 0.567 0 N-CA-C 113.401 0.889 . . . . 2.6600000000000001 113.401 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -73.74 -41.91 61.87 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.505 -0.771 . . . . 2.4399999999999999 112.17 -176.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -64.9 -40.18 94.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.16 0.505 . . . . 2.0800000000000001 110.831 171.224 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 513' ' ' GLU . . . . . 0.426 ' HG2' ' HB2' ' B' ' 508' ' ' MET . 43.2 mt-10 -53.61 -48.76 68.98 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.357 -0.838 . . . . 1.9199999999999999 111.084 177.35 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -54.76 -57.66 10.66 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 111.917 0.34 . . . . 2.73 111.917 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 515' ' ' ARG . . . . . 0.523 ' O ' HG12 ' B' ' 518' ' ' VAL . 39.5 ttm180 -56.6 -35.93 68.83 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.132 0.895 . . . . 3.75 111.086 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.48 ' O ' HG23 ' B' ' 520' ' ' VAL . 56.7 t80 -76.14 -45.6 32.8 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.104 -0.953 . . . . 1.8899999999999999 110.504 -173.337 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 517' ' ' LEU . . . . . 0.491 ' O ' HG12 ' B' ' 521' ' ' ILE . 93.6 mt -66.72 -32.1 73.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.685 -0.689 . . . . 1.8999999999999999 112.752 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 518' ' ' VAL . . . . . 0.523 HG12 ' O ' ' B' ' 515' ' ' ARG . 12.6 p -67.6 -35.03 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 118.456 -1.297 . . . . 1.3999999999999999 109.075 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 40.6 p -73.01 -36.3 66.98 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.1799999999999999 112.391 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 520' ' ' VAL . . . . . 0.48 HG23 ' O ' ' B' ' 516' ' ' PHE . 51.1 t -71.29 -42.22 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.416 -0.356 . . . . 1.22 111.716 -174.42 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 521' ' ' ILE . . . . . 0.491 HG12 ' O ' ' B' ' 517' ' ' LEU . 18.6 pt -90.78 -25.68 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 115.391 1.626 . . . . 1.98 115.391 -175.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 26.6 ttpp -60.91 -35.12 75.86 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.681 -0.859 . . . . 2.5699999999999998 108.681 173.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -92.43 -21.52 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.991 1.478 . . . . 2.1699999999999999 114.991 -177.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 524' ' ' LEU . . . . . 0.55 ' HG ' HD11 ' B' ' 540' ' ' ILE . 4.6 mp -70.63 -45.43 65.21 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.28 -0.637 . . . . 1.48 109.28 169.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 26.9 tp -52.15 -45.56 65.07 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.253 0.549 . . . . 1.95 110.953 169.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.43 -40.52 94.47 Favored Glycine 0 N--CA 1.445 -0.735 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 527' ' ' LEU . . . . . 0.481 HD23 HD13 ' B' ' 540' ' ' ILE . 39.6 tp -63.55 -36.12 82.73 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.035 0.445 . . . . 1.6699999999999999 111.402 175.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 41.8 t -63.49 -47.81 80.22 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 116.065 -0.516 . . . . 0.58999999999999997 110.632 -175.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -61.73 -29.5 70.16 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.467 -0.788 . . . . 2.5 112.615 173.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -71.7 -54.76 9.27 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.336 0.865 . . . . 2.2400000000000002 113.336 -177.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.73 137.95 54.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.014 -0.539 . . . . 2.2799999999999998 111.099 -177.447 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 11.1 ptp180 -96.5 160.71 14.25 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.83 -0.623 . . . . 4.21 110.117 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.62 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.854 -0.612 . . . . 0.0 114.022 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -47.14 -36.58 8.64 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.207 0.817 . . . . 2.9500000000000002 113.207 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -50.59 -51.77 45.29 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 120.373 -0.531 . . . . 2.2000000000000002 110.846 174.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -66.14 -44.84 83.01 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.59 0.589 . . . . 1.47 112.59 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 537' ' ' LYS . . . . . 0.57 ' HA ' HG22 ' B' ' 540' ' ' ILE . 60.3 mttm -67.84 -32.0 72.22 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.263 -174.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.12 -46.91 69.58 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 115.832 -0.622 . . . . 0.040000000000000001 111.137 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 78.8 mt -58.25 -54.91 26.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 1.8200000000000001 111.247 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 540' ' ' ILE . . . . . 0.57 HG22 ' HA ' ' B' ' 537' ' ' LYS . 10.6 tp -56.73 -48.16 81.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.601 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 541' ' ' ALA . . . . . 0.467 ' O ' HG22 ' B' ' 544' ' ' ILE . . . -57.47 -44.04 84.52 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.573 0.953 . . . . 0.02 113.573 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 542' ' ' SER . . . . . 0.565 ' O ' ' HG2' ' B' ' 545' ' ' MET . 94.7 p -60.47 -38.74 85.21 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.574 -0.45 . . . . 1.2 110.296 -178.888 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 543' ' ' ASN . . . . . 0.468 ' O ' HD13 ' B' ' 547' ' ' ILE . 75.9 m-20 -69.03 -47.14 66.16 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.316 1.228 . . . . 2.0299999999999998 114.316 -175.238 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 544' ' ' ILE . . . . . 0.467 HG22 ' O ' ' B' ' 541' ' ' ALA . 14.7 tt -52.64 -46.0 48.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.46 -0.941 . . . . 1.8100000000000001 108.46 170.061 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 545' ' ' MET . . . . . 0.565 ' HG2' ' O ' ' B' ' 542' ' ' SER . 0.0 OUTLIER -64.04 -42.31 97.1 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.688 -0.805 . . . . 2.6000000000000001 112.757 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -58.34 -48.76 79.52 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 119.213 -0.995 . . . . 2.0800000000000001 109.867 176.55 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 547' ' ' ILE . . . . . 0.468 HD13 ' O ' ' B' ' 543' ' ' ASN . 1.7 mp -55.09 -61.38 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.854 0.687 . . . . 1.5 112.854 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 548' ' ' VAL . . . . . 0.618 HG22 HD11 ' B' ' 555' ' ' LEU . 9.9 p -47.29 -44.32 8.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.843 -0.743 . . . . 1.3999999999999999 111.43 176.193 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.02 58.81 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.764 -0.585 . . . . 0.0 112.934 -177.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 550' ' ' GLN . . . . . 0.467 ' C ' ' HD3' ' B' ' 552' ' ' PRO . 32.5 tt0 -87.06 -9.52 55.24 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.617 0.599 . . . . 2.27 112.617 -175.365 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -120.44 59.64 7.08 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 113.823 1.046 . . . . 3.5299999999999998 113.823 -176.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 552' ' ' PRO . . . . . 0.586 ' HG2' ' HG2' ' B' ' 594' ' ' LYS . 44.2 Cg_exo -55.96 -39.4 91.41 Favored 'Trans proline' 0 C--O 1.222 -0.291 0 O-C-N 122.124 0.539 . . . . 0.46000000000000002 113.151 177.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 553' ' ' ARG . . . . . 0.488 ' HA ' ' HE ' ' B' ' 556' ' ' ARG . 98.9 mtt180 -56.27 -46.68 79.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.164 0.507 . . . . 3.8700000000000001 109.99 -174.201 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.04 -59.7 3.4 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 123.931 0.892 . . . . 0.69999999999999996 112.108 167.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 555' ' ' LEU . . . . . 0.621 ' HB3' HD13 ' B' ' 562' ' ' LEU . 87.0 mt -54.4 -48.51 71.48 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 116.322 -0.399 . . . . 1.49 110.177 -178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 556' ' ' ARG . . . . . 0.488 ' HE ' ' HA ' ' B' ' 553' ' ' ARG . 59.5 mtm180 -53.93 -35.87 62.16 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.827 1.047 . . . . 3.0899999999999999 113.827 -178.313 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.03 -12.26 50.73 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.528 -0.469 . . . . 0.0 112.078 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 558' ' ' HIS . . . . . 0.577 ' ND1' ' HB2' ' B' ' 561' ' ' PHE . 8.5 t-160 -128.22 78.48 1.84 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.405 1.261 . . . . 2.9300000000000002 114.405 -177.518 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 34.6 p90 -50.48 -48.29 56.8 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 116.526 2.047 . . . . 3.1099999999999999 116.526 -176.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 560' ' ' LYS . . . . . 0.418 ' O ' HG23 ' B' ' 564' ' ' THR . 5.0 tppp? -56.71 -36.55 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.303 -0.408 . . . . 3.3199999999999998 111.15 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 561' ' ' PHE . . . . . 0.577 ' HB2' ' ND1' ' B' ' 558' ' ' HIS . 9.0 t80 -74.96 -45.06 44.86 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 119.1 -1.04 . . . . 1.25 111.908 175.587 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 562' ' ' LEU . . . . . 0.621 HD13 ' HB3' ' B' ' 555' ' ' LEU . 62.3 tp -49.97 -59.22 4.09 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.515 0.326 . . . . 1.3200000000000001 110.255 175.031 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 563' ' ' LYS . . . . . 0.511 ' O ' HG12 ' B' ' 566' ' ' VAL . 39.7 ttmt -50.16 -38.66 40.54 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.893 1.071 . . . . 2.7400000000000002 113.893 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 564' ' ' THR . . . . . 0.418 HG23 ' O ' ' B' ' 560' ' ' LYS . 23.5 p -71.71 -39.42 70.17 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.572 0.701 . . . . 1.24 110.412 -176.131 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 565' ' ' VAL . . . . . 0.467 HG23 ' O ' ' B' ' 561' ' ' PHE . 85.1 t -62.84 -41.34 92.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.646 -0.706 . . . . 1.1899999999999999 112.527 173.391 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 566' ' ' VAL . . . . . 0.511 HG12 ' O ' ' B' ' 563' ' ' LYS . 13.1 p -70.96 -50.85 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.537 -0.465 . . . . 1.3600000000000001 110.875 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 567' ' ' ASN . . . . . 0.437 ' N ' HG13 ' B' ' 566' ' ' VAL . 42.7 t30 -51.04 -37.47 45.55 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.009 -0.541 . . . . 1.9399999999999999 112.044 170.508 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -72.69 -32.63 65.93 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.716 -0.475 . . . . 3.5299999999999998 109.716 -179.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 569' ' ' LEU . . . . . 0.489 ' O ' ' HG3' ' B' ' 573' ' ' MET . 60.1 mt -67.5 -36.41 81.02 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 108.696 -0.853 . . . . 2.0099999999999998 108.696 177.045 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 570' ' ' PHE . . . . . 0.41 ' CE2' HG22 ' B' ' 566' ' ' VAL . 25.2 m-85 -65.35 -39.38 92.28 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.868 -0.419 . . . . 3.77 109.868 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -57.7 -53.51 57.38 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 119.985 -0.686 . . . . 2.4700000000000002 110.495 176.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 572' ' ' PHE . . . . . 0.631 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 18.6 m-85 -62.44 -9.86 9.79 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.093 1.146 . . . . 1.23 114.093 -177.189 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 573' ' ' MET . . . . . 0.906 ' HB3' HD11 ' B' ' 625' ' ' LEU . 67.9 mtt -76.47 -5.26 46.7 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.637 0.732 . . . . 2.1099999999999999 109.662 178.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -109.49 -0.57 18.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.765 -1.107 . . . . 3.2000000000000002 111.492 173.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 575' ' ' GLU . . . . . 0.631 ' HG2' ' HA ' ' B' ' 572' ' ' PHE . 25.2 mm-40 -68.47 130.15 42.01 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.169 -0.469 . . . . 1.55 110.214 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 76.8 p -87.79 -21.41 25.12 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.941 0.719 . . . . 1.3999999999999999 112.941 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -60.1 128.05 34.9 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.418 0.627 . . . . 2.8500000000000001 112.584 -175.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -44.95 125.88 5.44 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.372 -0.831 . . . . 2.1499999999999999 113.103 -171.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 579' ' ' GLY . . . . . 0.415 ' O ' ' HG2' ' B' ' 583' ' ' MET . . . 96.23 -34.74 4.76 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.195 1.238 . . . . 0.0 116.195 174.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 47.1 t -53.77 -46.22 62.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.173 0.805 . . . . 1.29 113.173 -175.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -59.75 -42.27 92.87 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.333 0.494 . . . . 1.99 112.333 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -60.53 -42.46 96.55 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 112.202 0.445 . . . . 2.23 112.202 172.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 583' ' ' MET . . . . . 0.556 ' HB3' ' SD ' ' B' ' 545' ' ' MET . 28.6 mmt -60.66 -49.47 77.37 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.99 -0.284 . . . . 2.5800000000000001 110.475 175.508 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.97 80.32 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.197 -0.456 . . . . 0.029999999999999999 111.722 -177.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 77.5 m -74.32 -41.02 61.82 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 120.078 -0.649 . . . . 1.5 111.949 -177.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 586' ' ' ASP . . . . . 0.651 ' O ' HG22 ' B' ' 589' ' ' ILE . 69.2 m-20 -59.56 -46.3 89.3 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 116.252 -0.431 . . . . 1.98 111.984 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 587' ' ' THR . . . . . 0.413 ' OG1' ' HG3' ' B' ' 545' ' ' MET . 73.7 m -62.19 -41.22 98.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.3 110.43 175.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -61.45 -32.23 72.2 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.085 -0.507 . . . . 0.53000000000000003 111.177 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 589' ' ' ILE . . . . . 0.651 HG22 ' O ' ' B' ' 586' ' ' ASP . 10.0 tp -79.88 -35.95 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.835 -1.946 . . . . 1.97 109.74 -175.363 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 590' ' ' LYS . . . . . 0.429 ' O ' ' HE3' ' B' ' 594' ' ' LYS . 67.1 mttm -57.51 -50.02 74.44 Favored 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 107.697 -1.223 . . . . 2.6200000000000001 107.697 176.151 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 74.6 mt -63.76 -43.85 98.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 123.345 0.658 . . . . 1.96 112.77 -177.016 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.08 93.37 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.417 -0.513 . . . . 0.0 112.331 177.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -62.35 -70.14 0.22 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 119.12 -1.032 . . . . 2.3599999999999999 109.783 174.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 594' ' ' LYS . . . . . 0.586 ' HG2' ' HG2' ' B' ' 552' ' ' PRO . 0.0 OUTLIER -56.02 -23.79 35.27 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 116.69 2.107 . . . . 2.1899999999999999 116.69 -176.564 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 74.3 m -121.74 25.26 9.34 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.249 1.203 . . . . 1.26 114.249 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 596' ' ' ARG . . . . . 0.521 ' HG3' ' HD3' ' B' ' 597' ' ' ARG . 24.3 ptt180 -48.48 -38.54 20.32 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.856 1.799 . . . . 3.5800000000000001 115.856 -172.535 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 597' ' ' ARG . . . . . 0.521 ' HD3' ' HG3' ' B' ' 596' ' ' ARG . 0.5 OUTLIER -69.66 -32.53 71.24 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.225 0.824 . . . . 3.7400000000000002 113.225 -175.512 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 51.8 m-70 -70.09 -3.86 18.54 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-N 115.581 -0.736 . . . . 2.1400000000000001 112.054 -173.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -105.55 -16.93 14.57 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.613 0.571 . . . . 2.9500000000000002 110.18 -176.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 600' ' ' VAL . . . . . 0.414 HG22 ' O ' ' B' ' 597' ' ' ARG . 33.8 m -105.82 -24.41 4.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 CA-C-N 115.114 -0.948 . . . . 1.4199999999999999 111.242 -175.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 601' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 13.9 pt20 -101.95 139.49 37.51 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.56 -0.856 . . . . 2.3399999999999999 111.635 176.38 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 48.9 t -60.89 122.66 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 108.596 -0.89 . . . . 1.3700000000000001 108.596 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -92.67 167.3 11.99 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.649 0.593 . . . . 2.6800000000000002 110.138 -177.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 40.5 t -71.99 129.03 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 119.87 -0.732 . . . . 1.27 112.968 -175.233 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.31 6.6 64.45 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.096 -175.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 606' ' ' GLU . . . . . 0.505 ' HG3' ' H ' ' B' ' 608' ' ' MET . 10.5 tp10 -131.46 157.98 42.05 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.667 -0.813 . . . . 2.5099999999999998 110.841 175.537 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 33.9 m -103.24 -22.53 4.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.063 -0.972 . . . . 1.3999999999999999 112.507 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 608' ' ' MET . . . . . 0.505 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 52.6 ttm -136.97 142.18 37.5 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.651 0.611 . . . . 2.6800000000000002 112.651 -174.2 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 609' ' ' PRO . . . . . 0.499 ' HD2' ' HG3' ' B' ' 608' ' ' MET . 54.2 Cg_exo -52.11 130.96 37.28 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.89 1.06 . . . . 0.42999999999999999 112.086 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -57.03 -31.86 65.58 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 123.183 0.302 . . . . 2.3700000000000001 111.799 -174.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 611' ' ' ILE . . . . . 0.42 HG23 ' N ' ' B' ' 612' ' ' ASP . 13.4 tt -49.92 -44.97 21.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 120.816 0.341 . . . . 1.8400000000000001 110.538 178.207 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 612' ' ' ASP . . . . . 0.42 ' N ' HG23 ' B' ' 611' ' ' ILE . 15.0 m-20 -49.86 -52.0 36.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.612 0.765 . . . . 2.1499999999999999 112.875 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.02 -37.06 78.64 Favored 'General case' 0 C--O 1.244 0.802 0 C-N-CA 120.555 -0.458 . . . . 2.6600000000000001 110.183 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 72.6 mt -64.53 -47.93 87.1 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 120.214 -0.594 . . . . 1.76 112.002 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 93.3 mt -62.67 -31.17 72.0 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.955 0.724 . . . . 1.8400000000000001 112.955 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -79.5 2.12 23.23 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.621 1.341 . . . . 2.0600000000000001 114.621 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 617' ' ' ASN . . . . . 0.574 ' HB2' HG22 ' B' ' 620' ' ' THR . 26.2 p30 -142.44 15.62 2.01 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.168 0.803 . . . . 1.97 113.168 -174.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 618' ' ' ILE . . . . . 0.496 HG13 ' N ' ' B' ' 619' ' ' ASN . 16.7 pt -46.9 -47.02 8.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.0099999999999998 110.222 -176.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 619' ' ' ASN . . . . . 0.496 ' N ' HG13 ' B' ' 618' ' ' ILE . 7.3 t30 -63.12 -51.21 67.44 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 113.777 1.028 . . . . 2.2799999999999998 113.777 -176.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 620' ' ' THR . . . . . 0.574 HG22 ' HB2' ' B' ' 617' ' ' ASN . 4.1 t -56.82 -31.87 65.16 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 119.445 -0.902 . . . . 1.3200000000000001 110.785 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 621' ' ' ILE . . . . . 0.521 HG13 HG23 ' B' ' 622' ' ' ILE . 36.1 pt -79.26 -42.73 23.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 115.342 1.608 . . . . 2.0 115.342 -179.036 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 622' ' ' ILE . . . . . 0.737 ' HA ' HD13 ' B' ' 625' ' ' LEU . 39.5 pt -87.67 -6.32 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 115.031 1.493 . . . . 2.0899999999999999 115.031 -177.617 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.3 t -19.9 -58.33 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 116.642 2.09 . . . . 1.47 116.642 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -99.35 -7.53 26.11 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.028 -1.442 . . . . 2.0699999999999998 110.973 -163.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 625' ' ' LEU . . . . . 0.906 HD11 ' HB3' ' B' ' 573' ' ' MET . 9.5 mp -71.81 146.85 47.75 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.493 -0.321 . . . . 1.6699999999999999 111.748 -173.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 626' ' ' GLN . . . . . 0.422 ' O ' HG23 ' B' ' 630' ' ' VAL . 96.7 mt-30 -76.73 162.09 71.69 Favored Pre-proline 0 N--CA 1.464 0.237 0 N-CA-C 108.843 -0.799 . . . . 2.3500000000000001 108.843 174.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -47.81 -43.6 28.82 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.823 1.432 . . . . 0.44 115.823 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -67.33 -43.0 82.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.427 -0.509 . . . . 2.6200000000000001 109.631 -174.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -63.31 -38.2 90.22 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.924 -0.58 . . . . 2.0600000000000001 110.924 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 630' ' ' VAL . . . . . 0.422 HG23 ' O ' ' B' ' 626' ' ' GLN . 90.7 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.195 -0.907 . . . . 1.3 110.615 176.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 504' ' ' ILE . . . . . 0.432 ' N ' HD13 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.339 0 N-CA-C 113.069 0.766 . . . . 2.1299999999999999 113.069 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 79.2 p -48.83 119.13 2.95 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.542 0.571 . . . . 1.29 112.542 174.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.82 1.43 67.85 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 120.926 -0.654 . . . . 0.0 114.477 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.53 41.5 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.627 0.714 . . . . 0.02 112.443 176.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 63.2 mtt -112.47 159.99 18.22 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.11 0.481 . . . . 2.21 112.221 174.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -69.79 134.25 48.34 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.061 -0.718 . . . . 2.6699999999999999 109.061 174.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -41.62 -35.48 0.76 Allowed 'General case' 0 C--O 1.241 0.623 0 N-CA-C 113.39 0.885 . . . . 2.6600000000000001 113.39 -173.283 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -73.8 -41.92 61.69 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.541 -0.754 . . . . 2.4399999999999999 112.087 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -64.88 -40.1 94.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.111 0.482 . . . . 2.0800000000000001 110.863 171.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -53.64 -48.71 69.12 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.38 -0.827 . . . . 1.9199999999999999 111.141 177.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 514' ' ' LYS . . . . . 0.541 ' O ' HG13 ' B' ' 518' ' ' VAL . 39.0 ttmt -54.88 -57.56 11.11 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 111.93 0.345 . . . . 2.73 111.93 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 515' ' ' ARG . . . . . 0.523 ' O ' HG22 ' B' ' 518' ' ' VAL . 28.2 mmm180 -56.62 -35.94 68.89 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 124.221 0.951 . . . . 3.75 111.124 -177.555 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.718 ' O ' HG13 ' B' ' 520' ' ' VAL . 70.8 t80 -76.08 -45.58 33.34 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.101 -0.954 . . . . 1.8899999999999999 110.515 -173.37 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 517' ' ' LEU . . . . . 0.748 ' HA ' HG22 ' B' ' 520' ' ' VAL . 3.1 tt -66.76 -32.24 73.41 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.755 -0.657 . . . . 1.8999999999999999 112.606 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 518' ' ' VAL . . . . . 0.541 HG13 ' O ' ' B' ' 514' ' ' LYS . 34.2 m -67.53 -35.07 72.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 118.473 -1.291 . . . . 1.3999999999999999 109.087 178.544 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 47.8 m -72.96 -36.35 67.13 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.295 0.569 . . . . 1.1799999999999999 112.437 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 520' ' ' VAL . . . . . 0.748 HG22 ' HA ' ' B' ' 517' ' ' LEU . 22.0 m -71.23 -42.35 74.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.418 -0.355 . . . . 1.22 111.643 -174.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 521' ' ' ILE . . . . . 0.701 HG23 HG23 ' B' ' 520' ' ' VAL . 30.5 pt -90.64 -25.75 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 115.487 1.662 . . . . 1.98 115.487 -175.146 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.88 -35.24 76.12 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.694 -0.854 . . . . 2.5699999999999998 108.694 173.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 523' ' ' ASP . . . . . 0.404 ' O ' ' HG ' ' B' ' 527' ' ' LEU . 18.5 t70 -92.36 -21.49 20.21 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.037 1.495 . . . . 2.1699999999999999 115.037 -177.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 524' ' ' LEU . . . . . 0.494 HD13 ' O ' ' B' ' 520' ' ' VAL . 5.2 mp -70.61 -45.33 65.46 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.305 -0.628 . . . . 1.48 109.305 168.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 44.5 tp -52.31 -45.46 65.57 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 121.236 0.541 . . . . 1.95 110.91 169.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 526' ' ' GLY . . . . . 0.458 ' O ' ' HG2' ' B' ' 529' ' ' GLU . . . -66.5 -40.56 94.33 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -178.539 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 527' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' B' ' 523' ' ' ASP . 74.6 mt -63.57 -36.12 82.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 1.6699999999999999 111.47 175.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 42.4 t -63.5 -47.77 80.36 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.041 -0.527 . . . . 0.58999999999999997 110.634 -175.281 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 529' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' B' ' 526' ' ' GLY . 10.9 pt-20 -61.58 -29.71 70.2 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.544 -0.753 . . . . 2.5 112.542 173.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -71.62 -54.74 9.43 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.375 0.88 . . . . 2.2400000000000002 113.375 -177.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -68.76 137.95 54.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.0 -0.545 . . . . 2.2799999999999998 111.07 -177.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 532' ' ' ARG . . . . . 0.405 ' HG2' ' N ' ' B' ' 533' ' ' GLY . 68.2 ttt180 -96.46 160.6 14.32 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.813 -0.631 . . . . 4.21 110.16 178.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 533' ' ' GLY . . . . . 0.405 ' N ' ' HG2' ' B' ' 532' ' ' ARG . . . 87.53 119.56 1.37 Allowed Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 115.848 -0.614 . . . . 0.0 114.007 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -47.08 -36.63 8.42 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.241 0.83 . . . . 2.9500000000000002 113.241 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -50.52 -51.92 43.3 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 120.33 -0.548 . . . . 2.2000000000000002 110.851 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 536' ' ' ASN . . . . . 0.498 ' O ' HG22 ' B' ' 539' ' ' ILE . 18.7 m120 -65.95 -44.87 83.74 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.717 0.636 . . . . 1.47 112.717 178.271 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 537' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -67.76 -32.04 72.36 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.408 -0.517 . . . . 2.5 110.283 -174.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.13 -46.92 69.5 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.896 -0.593 . . . . 0.040000000000000001 111.112 178.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 539' ' ' ILE . . . . . 0.498 HG22 ' O ' ' B' ' 536' ' ' ASN . 0.4 OUTLIER -58.19 -54.92 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.56 0.695 . . . . 1.8200000000000001 111.307 173.42 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 540' ' ' ILE . . . . . 0.494 ' N ' ' CG2' ' B' ' 539' ' ' ILE . 82.4 mt -56.77 -48.18 81.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.566 -178.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.38 -44.05 84.1 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 113.68 0.993 . . . . 0.02 113.68 179.349 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 63.4 m -60.43 -38.76 85.11 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.619 -0.432 . . . . 1.2 110.351 -178.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 543' ' ' ASN . . . . . 0.434 ' O ' HG12 ' B' ' 547' ' ' ILE . 42.1 t30 -69.0 -47.14 66.23 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.316 1.228 . . . . 2.0299999999999998 114.316 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 544' ' ' ILE . . . . . 0.402 HG12 ' HB3' ' B' ' 524' ' ' LEU . 57.6 mt -52.64 -45.96 48.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.471 -0.937 . . . . 1.8100000000000001 108.471 170.076 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 545' ' ' MET . . . . . 0.762 ' HB3' HG21 ' B' ' 587' ' ' THR . 50.6 mtp -64.05 -42.24 97.11 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 119.718 -0.793 . . . . 2.6000000000000001 112.828 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -58.37 -48.8 79.42 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 119.272 -0.971 . . . . 2.0800000000000001 109.829 176.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 547' ' ' ILE . . . . . 0.517 ' O ' ' HG2' ' B' ' 550' ' ' GLN . 43.2 mm -55.06 -61.36 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.854 0.687 . . . . 1.5 112.854 179.173 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 548' ' ' VAL . . . . . 0.617 HG22 HD11 ' B' ' 555' ' ' LEU . 12.4 p -47.41 -44.23 9.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 C-N-CA 119.892 -0.723 . . . . 1.3999999999999999 111.388 176.262 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.32 -28.1 58.68 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.799 -0.563 . . . . 0.0 112.916 -177.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 550' ' ' GLN . . . . . 0.517 ' HG2' ' O ' ' B' ' 547' ' ' ILE . 7.5 pt20 -87.08 -9.55 55.12 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.598 0.592 . . . . 2.27 112.598 -175.26 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -120.38 59.69 6.99 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.773 1.027 . . . . 3.5299999999999998 113.773 -176.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 552' ' ' PRO . . . . . 0.466 ' HD3' ' C ' ' B' ' 550' ' ' GLN . 44.6 Cg_exo -55.96 -39.35 91.72 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.068 0.509 . . . . 0.46000000000000002 113.139 177.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -56.32 -46.67 79.77 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.153 0.501 . . . . 3.8700000000000001 109.968 -174.18 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -48.93 -59.79 3.3 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 123.956 0.902 . . . . 0.69999999999999996 112.113 167.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 555' ' ' LEU . . . . . 0.617 HD11 HG22 ' B' ' 548' ' ' VAL . 77.4 mt -54.33 -48.6 71.2 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.281 -0.418 . . . . 1.49 110.17 -178.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 556' ' ' ARG . . . . . 0.44 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 46.5 ttp180 -53.91 -35.9 62.14 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.752 1.019 . . . . 3.0899999999999999 113.752 -178.239 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.05 -12.13 51.02 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.513 -0.475 . . . . 0.0 112.08 -177.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 558' ' ' HIS . . . . . 0.481 ' ND1' ' HB2' ' B' ' 561' ' ' PHE . 18.7 t-160 -128.28 78.45 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.399 1.259 . . . . 2.9300000000000002 114.399 -177.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 559' ' ' TRP . . . . . 0.413 ' HB2' ' OE1' ' B' ' 603' ' ' GLN . 17.2 p90 -50.39 -48.3 56.02 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 116.613 2.079 . . . . 3.1099999999999999 116.613 -176.114 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 24.1 ttmm -56.6 -36.69 69.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.265 -0.425 . . . . 3.3199999999999998 111.073 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 561' ' ' PHE . . . . . 0.556 ' O ' HG13 ' B' ' 565' ' ' VAL . 0.1 OUTLIER -74.91 -45.08 45.02 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.061 -1.055 . . . . 1.25 111.897 175.68 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 562' ' ' LEU . . . . . 0.855 ' O ' HG22 ' B' ' 565' ' ' VAL . 6.4 tt -49.94 -59.12 4.17 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 122.459 0.304 . . . . 1.3200000000000001 110.338 175.023 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -50.22 -38.64 41.31 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.863 1.061 . . . . 2.7400000000000002 113.863 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 37.8 m -71.81 -39.42 69.86 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.487 0.66 . . . . 1.24 110.294 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 565' ' ' VAL . . . . . 0.855 HG22 ' O ' ' B' ' 562' ' ' LEU . 4.8 m -62.85 -41.28 91.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.687 -0.688 . . . . 1.1899999999999999 112.529 173.42 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 566' ' ' VAL . . . . . 0.557 HG22 HD12 ' B' ' 591' ' ' ILE . 47.9 t -71.06 -50.84 39.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 C-N-CA 120.537 -0.465 . . . . 1.3600000000000001 110.798 -176.481 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -51.04 -37.42 45.26 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.035 -0.53 . . . . 1.9399999999999999 112.067 170.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -72.72 -32.58 65.82 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.736 -0.468 . . . . 3.5299999999999998 109.736 -179.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 569' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' B' ' 565' ' ' VAL . 71.3 mt -67.52 -36.53 81.23 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 108.648 -0.871 . . . . 2.0099999999999998 108.648 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -65.29 -39.34 92.42 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.915 -0.402 . . . . 3.77 109.915 178.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.68 -53.58 56.63 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 120.011 -0.676 . . . . 2.4700000000000002 110.465 176.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 572' ' ' PHE . . . . . 0.559 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 23.5 m-85 -62.44 -9.9 9.91 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.121 1.156 . . . . 1.23 114.121 -177.135 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 573' ' ' MET . . . . . 0.605 ' HB3' HD21 ' B' ' 625' ' ' LEU . 67.9 mtt -76.39 -5.34 46.86 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.648 0.737 . . . . 2.1099999999999999 109.641 178.618 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -109.43 -0.57 18.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.815 -1.084 . . . . 3.2000000000000002 111.431 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 575' ' ' GLU . . . . . 0.753 ' HB3' HG21 ' B' ' 580' ' ' VAL . 48.4 mm-40 -68.59 130.24 42.26 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 116.195 -0.457 . . . . 1.55 110.124 177.514 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 64.0 p -87.89 -21.21 25.1 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.026 0.75 . . . . 1.3999999999999999 113.026 -177.203 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 577' ' ' HIS . . . . . 0.694 ' O ' HG22 ' B' ' 580' ' ' VAL . 64.7 t-80 -60.21 128.0 34.62 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.402 0.62 . . . . 2.8500000000000001 112.528 -175.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -44.85 125.86 5.33 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.397 -0.82 . . . . 2.1499999999999999 113.139 -171.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.72 4.76 Favored Glycine 0 C--O 1.223 -0.567 0 N-CA-C 116.299 1.28 . . . . 0.0 116.299 175.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 580' ' ' VAL . . . . . 0.753 HG21 ' HB3' ' B' ' 575' ' ' GLU . 23.5 m -53.81 -46.31 63.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.096 0.776 . . . . 1.29 113.096 -175.456 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.495 ' N ' HG23 ' B' ' 580' ' ' VAL . 75.4 mt-30 -59.67 -42.3 92.56 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.371 0.508 . . . . 1.99 112.371 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -60.54 -42.4 96.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 112.232 0.456 . . . . 2.23 112.232 172.141 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 7.2 tpt -60.68 -49.51 77.21 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.084 -0.246 . . . . 2.5800000000000001 110.453 175.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.7 -43.0 80.11 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.129 -0.487 . . . . 0.029999999999999999 111.81 -177.229 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 50.2 t -74.35 -40.93 61.82 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.03 -0.668 . . . . 1.5 112.004 -177.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 586' ' ' ASP . . . . . 0.619 ' O ' HG22 ' B' ' 589' ' ' ILE . 0.7 OUTLIER -59.6 -46.29 89.4 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.249 -0.432 . . . . 1.98 111.974 -179.899 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 587' ' ' THR . . . . . 0.762 HG21 ' HB3' ' B' ' 545' ' ' MET . 41.7 p -62.23 -41.23 98.23 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.372 0.669 . . . . 1.3 110.358 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 588' ' ' PHE . . . . . 0.542 ' HA ' HG12 ' B' ' 591' ' ' ILE . 88.2 t80 -61.46 -32.15 72.14 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.118 -0.492 . . . . 0.53000000000000003 111.186 -177.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 589' ' ' ILE . . . . . 0.619 HG22 ' O ' ' B' ' 586' ' ' ASP . 20.1 tt -79.87 -35.95 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.878 -1.929 . . . . 1.97 109.8 -175.418 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -57.56 -49.86 74.99 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 107.779 -1.193 . . . . 2.6200000000000001 107.779 176.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 591' ' ' ILE . . . . . 0.557 HD12 HG22 ' B' ' 566' ' ' VAL . 34.5 pt -63.91 -43.64 97.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.784 0.661 . . . . 1.96 112.784 -176.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 592' ' ' ALA . . . . . 0.498 ' N ' HG13 ' B' ' 591' ' ' ILE . . . -63.94 -39.17 93.53 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.535 -0.466 . . . . 0.0 112.217 177.621 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -62.3 -70.14 0.22 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.14 -1.024 . . . . 2.3599999999999999 109.795 174.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -56.13 -23.72 36.28 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 116.623 2.082 . . . . 2.1899999999999999 116.623 -176.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 74.8 m -121.66 25.15 9.44 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 114.331 1.234 . . . . 1.26 114.331 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -48.5 -38.52 20.4 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.887 1.81 . . . . 3.5800000000000001 115.887 -172.408 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 597' ' ' ARG . . . . . 0.422 ' O ' ' HG2' ' B' ' 601' ' ' GLN . 34.5 ttm180 -69.56 -32.63 71.52 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.242 0.831 . . . . 3.7400000000000002 113.242 -175.546 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 598' ' ' HIS . . . . . 0.44 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 57.2 m-70 -70.07 -3.84 18.37 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.595 -0.73 . . . . 2.1400000000000001 112.107 -173.663 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -105.54 -16.88 14.59 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 123.597 0.561 . . . . 2.9500000000000002 110.231 -176.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 35.8 m -105.9 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.11 -0.95 . . . . 1.4199999999999999 111.276 -175.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 601' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 29.3 pt20 -102.05 139.52 37.57 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 119.563 -0.855 . . . . 2.3399999999999999 111.561 176.444 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 7.4 m -60.95 122.74 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.597 -0.89 . . . . 1.3700000000000001 108.597 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 603' ' ' GLN . . . . . 0.413 ' OE1' ' HB2' ' B' ' 559' ' ' TRP . 10.6 pt20 -92.79 167.31 11.95 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.631 0.582 . . . . 2.6800000000000002 110.048 -177.553 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 41.3 t -71.99 129.01 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 N-CA-C 112.958 0.725 . . . . 1.27 112.958 -175.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.35 6.52 64.44 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.059 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 606' ' ' GLU . . . . . 0.537 ' HG3' ' H ' ' B' ' 608' ' ' MET . 8.7 tp10 -131.44 157.97 42.06 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.639 -0.825 . . . . 2.5099999999999998 110.808 175.614 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 607' ' ' VAL . . . . . 0.538 HG13 ' HG2' ' B' ' 608' ' ' MET . 13.9 p -103.26 -22.46 4.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.097 -0.956 . . . . 1.3999999999999999 112.49 -175.164 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 608' ' ' MET . . . . . 0.538 ' HG2' HG13 ' B' ' 607' ' ' VAL . 22.2 mmt -137.02 142.22 37.57 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.601 0.593 . . . . 2.6800000000000002 112.601 -174.221 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 609' ' ' PRO . . . . . 0.542 ' HB2' HG22 ' B' ' 611' ' ' ILE . 9.7 Cg_endo -52.08 130.9 36.93 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.42999999999999999 112.131 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -57.0 -31.84 65.5 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 111.823 0.305 . . . . 2.3700000000000001 111.823 -174.137 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 611' ' ' ILE . . . . . 0.542 HG22 ' HB2' ' B' ' 609' ' ' PRO . 14.0 tt -50.0 -44.93 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 CA-C-O 120.816 0.341 . . . . 1.8400000000000001 110.496 178.229 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 612' ' ' ASP . . . . . 0.413 ' N ' HG23 ' B' ' 611' ' ' ILE . 20.9 t70 -49.88 -52.0 36.23 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.646 0.778 . . . . 2.1499999999999999 112.875 177.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 613' ' ' GLU . . . . . 0.457 ' O ' ' ND2' ' B' ' 617' ' ' ASN . 10.5 mm-40 -59.95 -37.13 78.67 Favored 'General case' 0 C--O 1.244 0.795 0 C-N-CA 120.59 -0.444 . . . . 2.6600000000000001 110.189 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 73.0 mt -64.45 -48.05 86.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 C-N-CA 120.262 -0.575 . . . . 1.76 111.973 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 59.8 tp -62.6 -31.13 71.91 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.03 0.752 . . . . 1.8400000000000001 113.03 -177.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -79.6 2.16 23.4 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.639 1.348 . . . . 2.0600000000000001 114.639 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 617' ' ' ASN . . . . . 0.457 ' ND2' ' O ' ' B' ' 613' ' ' GLU . 29.8 p30 -142.42 15.67 2.02 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.117 0.784 . . . . 1.97 113.117 -174.283 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 618' ' ' ILE . . . . . 0.469 HG23 ' N ' ' B' ' 619' ' ' ASN . 13.5 tt -46.87 -46.98 8.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.0099999999999998 110.263 -176.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 619' ' ' ASN . . . . . 0.469 ' N ' HG23 ' B' ' 618' ' ' ILE . 22.7 p-10 -63.24 -51.06 67.74 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.754 1.02 . . . . 2.2799999999999998 113.754 -176.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 620' ' ' THR . . . . . 0.423 ' OG1' ' HB2' ' B' ' 617' ' ' ASN . 56.8 p -56.94 -31.9 65.43 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.46 -0.896 . . . . 1.3200000000000001 110.741 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 621' ' ' ILE . . . . . 0.518 HG13 HG23 ' B' ' 622' ' ' ILE . 32.0 pt -79.27 -42.65 23.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.373 1.62 . . . . 2.0 115.373 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 622' ' ' ILE . . . . . 0.518 HG23 HG13 ' B' ' 621' ' ' ILE . 34.7 pt -87.67 -6.25 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 115.069 1.507 . . . . 2.0899999999999999 115.069 -177.69 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 40.2 t -19.98 -58.32 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.567 2.062 . . . . 1.47 116.567 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.23 -7.65 26.16 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.037 -1.438 . . . . 2.0699999999999998 110.994 -163.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 625' ' ' LEU . . . . . 0.605 HD21 ' HB3' ' B' ' 573' ' ' MET . 82.7 mt -71.78 146.9 47.78 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 123.311 0.382 . . . . 1.6699999999999999 111.773 -173.696 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 626' ' ' GLN . . . . . 0.531 ' HB3' ' HD2' ' B' ' 627' ' ' PRO . 97.2 mt-30 -76.75 162.1 71.64 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 108.827 -0.805 . . . . 2.3500000000000001 108.827 174.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 627' ' ' PRO . . . . . 0.531 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 6.3 Cg_endo -47.85 -43.55 29.14 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.823 1.432 . . . . 0.44 115.823 -178.431 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -67.32 -43.08 82.52 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.615 -0.513 . . . . 2.6200000000000001 109.615 -174.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -63.29 -38.29 90.58 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.951 -0.568 . . . . 2.0600000000000001 110.9 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 630' ' ' VAL . . . . . 0.459 HG23 ' O ' ' B' ' 626' ' ' GLN . 80.9 t . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.237 -0.887 . . . . 1.3 110.67 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 504' ' ' ILE . . . . . 0.461 ' N ' HD13 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.277 0 N-CA-C 113.094 0.776 . . . . 2.1299999999999999 113.094 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 74.9 m -48.84 119.11 2.94 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.519 0.563 . . . . 1.29 112.519 174.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.79 1.5 67.86 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 120.948 -0.644 . . . . 0.0 114.501 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.4 -7.57 41.21 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 117.549 0.674 . . . . 0.02 112.444 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 24.8 mmt -112.43 159.98 18.2 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.22 0.533 . . . . 2.21 112.262 174.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -69.64 134.28 48.53 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 109.051 -0.722 . . . . 2.6699999999999999 109.051 174.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.78 -35.39 0.79 Allowed 'General case' 0 C--O 1.239 0.533 0 N-CA-C 113.37 0.878 . . . . 2.6600000000000001 113.37 -173.239 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -73.82 -41.88 61.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.531 -0.759 . . . . 2.4399999999999999 112.1 -176.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -64.85 -40.18 94.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.182 0.515 . . . . 2.0800000000000001 110.873 171.179 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -53.7 -48.61 69.38 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.285 -0.87 . . . . 1.9199999999999999 111.107 177.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 514' ' ' LYS . . . . . 0.431 ' HE2' ' NE2' ' B' ' 558' ' ' HIS . 9.9 mtpm? -54.86 -57.67 10.66 Favored 'General case' 0 C--O 1.241 0.65 0 N-CA-C 111.889 0.329 . . . . 2.73 111.889 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 515' ' ' ARG . . . . . 0.445 ' O ' HG23 ' B' ' 519' ' ' THR . 74.5 mtp180 -56.63 -35.85 68.81 Favored 'General case' 0 CA--C 1.504 -0.817 0 O-C-N 124.129 0.893 . . . . 3.75 111.138 -177.503 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -76.15 -45.63 32.62 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.151 -0.932 . . . . 1.8899999999999999 110.515 -173.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 517' ' ' LEU . . . . . 0.622 ' HA ' HG12 ' B' ' 520' ' ' VAL . 8.2 tt -66.68 -32.26 73.46 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.761 -0.654 . . . . 1.8999999999999999 112.64 177.134 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 518' ' ' VAL . . . . . . . . . . . . . 44.6 t -67.47 -35.1 72.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 118.515 -1.274 . . . . 1.3999999999999999 109.081 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 519' ' ' THR . . . . . 0.445 HG23 ' O ' ' B' ' 515' ' ' ARG . 75.9 p -72.93 -36.42 67.22 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.451 0.643 . . . . 1.1799999999999999 112.42 178.475 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 520' ' ' VAL . . . . . 0.638 HG13 HG23 ' B' ' 521' ' ' ILE . 9.8 p -71.18 -42.36 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 O-C-N 122.094 -0.379 . . . . 1.22 111.673 -174.413 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 521' ' ' ILE . . . . . 0.638 HG23 HG13 ' B' ' 520' ' ' VAL . 26.2 pt -90.64 -25.8 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.442 1.645 . . . . 1.98 115.442 -175.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -60.82 -35.21 75.95 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.657 -0.868 . . . . 2.5699999999999998 108.657 173.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 523' ' ' ASP . . . . . 0.457 ' O ' HD23 ' B' ' 527' ' ' LEU . 10.0 m-20 -92.43 -21.46 20.18 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.987 1.477 . . . . 2.1699999999999999 114.987 -177.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 524' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' B' ' 520' ' ' VAL . 84.3 mt -70.6 -45.46 65.27 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 109.275 -0.639 . . . . 1.48 109.275 169.019 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 525' ' ' LEU . . . . . 0.683 HD22 HD13 ' B' ' 544' ' ' ILE . 3.7 mm? -52.16 -45.46 65.08 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.28 0.562 . . . . 1.95 110.97 169.712 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.5 -40.59 94.34 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 -178.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 527' ' ' LEU . . . . . 0.457 HD23 ' O ' ' B' ' 523' ' ' ASP . 2.5 mm? -63.57 -36.12 82.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 1.6699999999999999 111.47 175.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 528' ' ' CYS . . . . . 0.406 ' HA ' HG21 ' B' ' 540' ' ' ILE . 44.1 t -63.55 -47.6 80.9 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.041 -0.527 . . . . 0.58999999999999997 110.709 -175.282 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -61.78 -29.57 70.23 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.518 -0.764 . . . . 2.5 112.585 173.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -71.64 -54.76 9.35 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.358 0.873 . . . . 2.2400000000000002 113.358 -177.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -68.77 137.97 54.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.97 -0.559 . . . . 2.2799999999999998 111.002 -177.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 532' ' ' ARG . . . . . 0.434 ' HG2' ' N ' ' B' ' 533' ' ' GLY . 52.6 ttt180 -96.43 160.74 14.25 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.773 -0.649 . . . . 4.21 110.208 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 533' ' ' GLY . . . . . 0.434 ' N ' ' HG2' ' B' ' 532' ' ' ARG . . . 87.46 119.63 1.36 Allowed Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 115.982 -0.554 . . . . 0.0 113.954 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 534' ' ' LYS . . . . . 0.731 ' HD3' ' H ' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.04 -36.72 8.31 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.172 0.804 . . . . 2.9500000000000002 113.172 177.234 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -50.61 -51.8 45.33 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.868 -0.52 . . . . 2.2000000000000002 110.809 174.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 536' ' ' ASN . . . . . 0.581 ' O ' HG22 ' B' ' 539' ' ' ILE . 40.0 m-80 -66.13 -44.77 83.26 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.603 0.594 . . . . 1.47 112.603 178.322 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 537' ' ' LYS . . . . . 0.565 ' HA ' HG22 ' B' ' 540' ' ' ILE . 96.8 mttt -67.88 -31.95 72.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.427 -0.509 . . . . 2.5 110.331 -174.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.08 -46.97 69.53 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.822 -0.626 . . . . 0.040000000000000001 111.149 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 539' ' ' ILE . . . . . 0.581 HG22 ' O ' ' B' ' 536' ' ' ASN . 10.2 tp -58.1 -54.99 24.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 121.542 0.687 . . . . 1.8200000000000001 111.26 173.389 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 540' ' ' ILE . . . . . 0.565 HG22 ' HA ' ' B' ' 537' ' ' LYS . 10.0 tp -56.83 -48.07 81.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 121.672 -0.642 . . . . 1.8500000000000001 110.581 -178.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 541' ' ' ALA . . . . . 0.427 ' N ' HG23 ' B' ' 540' ' ' ILE . . . -57.55 -44.03 84.9 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 113.545 0.943 . . . . 0.02 113.545 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 542' ' ' SER . . . . . 0.478 ' HA ' ' HG2' ' B' ' 583' ' ' MET . 96.0 p -60.47 -38.72 85.14 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.625 -0.43 . . . . 1.2 110.297 -178.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 543' ' ' ASN . . . . . 0.45 ' O ' HG12 ' B' ' 547' ' ' ILE . 27.4 t-20 -69.08 -47.08 66.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 114.339 1.237 . . . . 2.0299999999999998 114.339 -175.24 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 544' ' ' ILE . . . . . 0.683 HD13 HD22 ' B' ' 525' ' ' LEU . 45.2 mt -52.71 -45.88 49.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.479 -0.934 . . . . 1.8100000000000001 108.479 170.043 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 545' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -64.02 -42.32 97.14 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.778 -0.769 . . . . 2.6000000000000001 112.766 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -58.33 -48.81 79.34 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 119.234 -0.986 . . . . 2.0800000000000001 109.845 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 547' ' ' ILE . . . . . 0.45 HG12 ' O ' ' B' ' 543' ' ' ASN . 44.8 mm -55.06 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.77 0.656 . . . . 1.5 112.77 179.208 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 548' ' ' VAL . . . . . 0.526 HG12 HD11 ' B' ' 555' ' ' LEU . 86.4 t -47.37 -44.22 8.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 C-N-CA 119.837 -0.745 . . . . 1.3999999999999999 111.454 176.281 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.41 -28.08 58.9 Favored Glycine 0 C--O 1.237 0.319 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -87.06 -9.48 55.35 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.571 0.582 . . . . 2.27 112.571 -175.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -120.4 59.64 7.0 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 113.79 1.033 . . . . 3.5299999999999998 113.79 -176.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -56.04 -39.3 92.05 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 O-C-N 122.189 0.573 . . . . 0.46000000000000002 113.132 178.002 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -56.39 -46.66 80.01 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 121.074 0.464 . . . . 3.8700000000000001 109.924 -174.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -48.9 -59.75 3.33 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 123.896 0.879 . . . . 0.69999999999999996 112.125 167.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 555' ' ' LEU . . . . . 0.607 ' HB3' HD13 ' B' ' 562' ' ' LEU . 83.8 mt -54.38 -48.58 71.36 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.304 -0.407 . . . . 1.49 110.158 -178.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 556' ' ' ARG . . . . . 0.472 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 76.8 ttt180 -53.83 -35.91 61.97 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 113.814 1.042 . . . . 3.0899999999999999 113.814 -178.302 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.09 -12.13 50.91 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.486 -0.486 . . . . 0.0 112.08 -177.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 558' ' ' HIS . . . . . 0.431 ' NE2' ' HE2' ' B' ' 514' ' ' LYS . 94.7 m-70 -128.28 78.48 1.84 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.405 1.261 . . . . 2.9300000000000002 114.405 -177.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 38.8 p90 -50.55 -48.25 57.48 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.505 2.039 . . . . 3.1099999999999999 116.505 -176.041 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.66 -36.62 69.76 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.378 -0.374 . . . . 3.3199999999999998 111.132 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 561' ' ' PHE . . . . . 0.465 ' O ' HG23 ' B' ' 565' ' ' VAL . 0.6 OUTLIER -74.9 -45.13 44.83 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 119.16 -1.016 . . . . 1.25 111.952 175.575 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 562' ' ' LEU . . . . . 0.607 HD13 ' HB3' ' B' ' 555' ' ' LEU . 58.5 tp -49.94 -59.22 4.07 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 122.428 0.291 . . . . 1.3200000000000001 110.264 174.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -50.11 -38.73 40.23 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.835 1.05 . . . . 2.7400000000000002 113.835 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 87.4 m -71.75 -39.35 70.09 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.553 0.692 . . . . 1.24 110.429 -176.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 565' ' ' VAL . . . . . 0.465 HG11 HG11 ' B' ' 548' ' ' VAL . 67.2 t -62.92 -41.15 91.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.618 -0.719 . . . . 1.1899999999999999 112.551 173.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 566' ' ' VAL . . . . . 0.478 HG23 ' O ' ' B' ' 562' ' ' LEU . 43.1 t -71.08 -50.89 39.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 120.546 -0.462 . . . . 1.3600000000000001 110.819 -176.53 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 567' ' ' ASN . . . . . 0.404 ' O ' ' HG2' ' B' ' 571' ' ' GLU . 49.8 t30 -51.1 -37.39 45.58 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.951 -0.568 . . . . 1.9399999999999999 112.029 170.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -72.6 -32.77 66.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.67 -0.493 . . . . 3.5299999999999998 109.67 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 569' ' ' LEU . . . . . 0.84 HD11 ' O ' ' B' ' 584' ' ' ALA . 1.8 tm? -67.44 -36.46 81.26 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.739 -0.837 . . . . 2.0099999999999998 108.739 177.107 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 570' ' ' PHE . . . . . 0.439 ' CE2' HG12 ' B' ' 566' ' ' VAL . 24.6 m-85 -65.41 -39.31 92.0 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.863 -0.421 . . . . 3.77 109.863 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' B' ' 567' ' ' ASN . 18.7 mm-40 -57.67 -53.56 56.78 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 119.908 -0.717 . . . . 2.4700000000000002 110.479 176.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -62.36 -10.03 10.02 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.108 1.151 . . . . 1.23 114.108 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 573' ' ' MET . . . . . 0.794 ' HB3' HD11 ' B' ' 625' ' ' LEU . 18.0 mtm -76.35 -5.34 46.74 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.616 0.722 . . . . 2.1099999999999999 109.641 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 29.6 m-70 -109.42 -0.61 18.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.815 -1.084 . . . . 3.2000000000000002 111.452 173.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 575' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -68.51 130.2 42.18 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.212 -0.449 . . . . 1.55 110.083 177.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 7.9 t -87.81 -21.32 25.14 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.027 0.751 . . . . 1.3999999999999999 113.027 -177.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -60.19 128.02 34.71 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.409 0.623 . . . . 2.8500000000000001 112.532 -175.356 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -44.89 125.91 5.4 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.315 -0.857 . . . . 2.1499999999999999 113.011 -171.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.76 4.74 Favored Glycine 0 C--O 1.222 -0.643 0 N-CA-C 116.323 1.289 . . . . 0.0 116.323 174.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 45.2 t -53.72 -46.37 62.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 113.186 0.81 . . . . 1.29 113.186 -175.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.578 ' HB2' HE22 ' B' ' 629' ' ' GLN . 13.5 pt20 -59.63 -42.31 92.43 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.384 0.513 . . . . 1.99 112.384 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -60.46 -42.45 96.22 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.168 0.433 . . . . 2.23 112.168 172.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 583' ' ' MET . . . . . 0.478 ' HG2' ' HA ' ' B' ' 542' ' ' SER . 37.1 tpp -60.74 -49.42 77.59 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 121.027 -0.269 . . . . 2.5800000000000001 110.431 175.626 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 584' ' ' ALA . . . . . 0.84 ' O ' HD11 ' B' ' 569' ' ' LEU . . . -56.85 -42.96 80.65 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.162 -0.472 . . . . 0.029999999999999999 111.692 -177.159 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 52.6 t -74.36 -40.93 61.8 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 120.041 -0.664 . . . . 1.5 111.943 -177.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 586' ' ' ASP . . . . . 0.632 ' O ' HG22 ' B' ' 589' ' ' ILE . 15.5 t70 -59.7 -46.26 89.63 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.312 -0.404 . . . . 1.98 111.935 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 46.8 m -62.15 -41.23 98.09 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.433 0.693 . . . . 1.3 110.39 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -61.5 -32.17 72.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.075 -0.511 . . . . 0.53000000000000003 111.142 -177.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 589' ' ' ILE . . . . . 0.632 HG22 ' O ' ' B' ' 586' ' ' ASP . 8.9 tp -79.95 -35.91 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.847 -1.941 . . . . 1.97 109.854 -175.42 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 590' ' ' LYS . . . . . 0.457 ' HB3' ' NZ ' ' B' ' 590' ' ' LYS . 3.7 mmmp? -57.46 -49.99 74.49 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 107.747 -1.205 . . . . 2.6200000000000001 107.747 176.025 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 87.8 mt -63.83 -43.76 97.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.725 -0.671 . . . . 1.96 112.739 -176.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.14 93.45 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.512 -0.475 . . . . 0.0 112.244 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -62.26 -70.19 0.21 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.222 -0.991 . . . . 2.3599999999999999 109.796 174.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -56.1 -23.86 36.72 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.562 2.06 . . . . 2.1899999999999999 116.562 -176.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 75.0 m -121.68 25.24 9.38 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.261 1.208 . . . . 1.26 114.261 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -48.48 -38.54 20.32 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.861 1.8 . . . . 3.5800000000000001 115.861 -172.527 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -69.56 -32.66 71.57 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.186 0.809 . . . . 3.7400000000000002 113.186 -175.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 598' ' ' HIS . . . . . 0.472 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 55.1 m-70 -70.12 -3.85 18.6 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.617 -0.72 . . . . 2.1400000000000001 112.072 -173.603 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -105.58 -16.93 14.57 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.585 0.553 . . . . 2.9500000000000002 110.228 -176.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 46.5 t -105.82 -24.39 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.017 -0.992 . . . . 1.4199999999999999 111.295 -175.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -101.99 139.5 37.54 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.547 -0.861 . . . . 2.3399999999999999 111.599 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 4.3 p -60.91 122.7 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 N-CA-C 108.599 -0.889 . . . . 1.3700000000000001 108.599 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -92.68 167.3 11.99 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.706 0.629 . . . . 2.6800000000000002 110.138 -177.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.01 129.08 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 C-N-CA 119.881 -0.728 . . . . 1.27 112.907 -175.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.26 6.58 64.55 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.069 -175.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 606' ' ' GLU . . . . . 0.555 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.1 tp10 -131.46 158.03 41.92 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.611 -0.836 . . . . 2.5099999999999998 110.78 175.585 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 33.3 m -103.24 -22.58 4.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.13 -0.941 . . . . 1.3999999999999999 112.582 -175.232 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 608' ' ' MET . . . . . 0.555 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 23.2 ptt? -136.92 142.25 37.89 Favored Pre-proline 0 C--O 1.223 -0.297 0 N-CA-C 112.611 0.597 . . . . 2.6800000000000002 112.611 -174.234 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.08 130.89 36.92 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.42999999999999999 112.131 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 610' ' ' PHE . . . . . 0.459 ' CE2' HD11 ' B' ' 614' ' ' ILE . 16.5 t80 -57.01 -31.87 65.55 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.792 0.293 . . . . 2.3700000000000001 111.792 -174.135 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 611' ' ' ILE . . . . . 0.403 HG23 ' N ' ' B' ' 612' ' ' ASP . 11.8 tt -50.05 -44.8 22.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.85 0.357 . . . . 1.8400000000000001 110.56 178.253 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 612' ' ' ASP . . . . . 0.403 ' N ' HG23 ' B' ' 611' ' ' ILE . 16.7 t70 -49.92 -52.01 36.57 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.623 0.769 . . . . 2.1499999999999999 112.906 177.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -59.84 -37.17 78.47 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 120.604 -0.438 . . . . 2.6600000000000001 110.223 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 614' ' ' ILE . . . . . 0.459 HD11 ' CE2' ' B' ' 610' ' ' PHE . 31.9 mm -64.55 -47.98 86.87 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.181 -0.607 . . . . 1.76 111.922 178.736 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 8.4 tt -62.63 -31.11 71.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.98 0.733 . . . . 1.8400000000000001 112.98 -177.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -79.57 2.15 23.36 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.61 1.337 . . . . 2.0600000000000001 114.61 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -142.41 15.66 2.02 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 113.103 0.779 . . . . 1.97 113.103 -174.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 618' ' ' ILE . . . . . 0.502 ' N ' HD13 ' B' ' 618' ' ' ILE . 0.2 OUTLIER -47.0 -46.98 8.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 C-N-CA 118.957 -1.097 . . . . 2.0099999999999998 110.183 -176.663 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 619' ' ' ASN . . . . . 0.494 ' N ' HG12 ' B' ' 618' ' ' ILE . 6.0 p30 -63.19 -51.11 67.65 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.759 1.022 . . . . 2.2799999999999998 113.759 -176.385 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 76.3 p -56.85 -31.88 65.23 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 119.449 -0.9 . . . . 1.3200000000000001 110.804 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 621' ' ' ILE . . . . . 0.548 HG13 HG12 ' B' ' 622' ' ' ILE . 42.0 pt -79.35 -42.62 23.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.322 1.601 . . . . 2.0 115.322 -179.003 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 622' ' ' ILE . . . . . 0.694 ' HA ' HD13 ' B' ' 625' ' ' LEU . 19.7 mm -87.72 -6.26 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 115.035 1.494 . . . . 2.0899999999999999 115.035 -177.65 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.6 t -19.98 -58.29 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.567 2.062 . . . . 1.47 116.567 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -99.27 -7.58 26.18 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.063 -1.426 . . . . 2.0699999999999998 111.022 -163.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 625' ' ' LEU . . . . . 0.794 HD11 ' HB3' ' B' ' 573' ' ' MET . 8.3 mp -71.83 146.82 47.74 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.409 -0.36 . . . . 1.6699999999999999 111.7 -173.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 626' ' ' GLN . . . . . 0.724 ' O ' HG13 ' B' ' 630' ' ' VAL . 18.9 pt20 -76.65 162.13 71.68 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 108.814 -0.81 . . . . 2.3500000000000001 108.814 174.68 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 627' ' ' PRO . . . . . 0.787 ' O ' HG22 ' B' ' 630' ' ' VAL . 79.4 Cg_exo -47.96 -43.51 29.86 Favored 'Trans proline' 0 C--O 1.233 0.263 0 N-CA-C 115.827 1.434 . . . . 0.44 115.827 -178.469 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -67.33 -43.01 82.65 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.602 -0.518 . . . . 2.6200000000000001 109.602 -174.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 629' ' ' GLN . . . . . 0.578 HE22 ' HB2' ' B' ' 581' ' ' GLN . 28.9 mt-30 -63.23 -38.34 90.8 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.944 -0.571 . . . . 2.0600000000000001 110.928 178.65 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 630' ' ' VAL . . . . . 0.787 HG22 ' O ' ' B' ' 627' ' ' PRO . 1.0 OUTLIER . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.213 -0.898 . . . . 1.3 110.669 176.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 504' ' ' ILE . . . . . 0.939 HG13 ' HB3' ' B' ' 507' ' ' ALA . 8.0 tp . . . . . 0 C--O 1.236 0.342 0 N-CA-C 112.985 0.735 . . . . 2.1299999999999999 112.985 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 505' ' ' SER . . . . . 0.439 ' HB3' ' HG2' ' B' ' 550' ' ' GLN . 79.5 p -48.9 119.16 3.0 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.553 0.575 . . . . 1.29 112.553 174.597 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.86 1.38 67.78 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.92 -0.657 . . . . 0.0 114.407 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 507' ' ' ALA . . . . . 0.939 ' HB3' HG13 ' B' ' 504' ' ' ILE . . . -94.26 -7.6 41.55 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 117.677 0.738 . . . . 0.02 112.48 176.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 26.4 mmt -112.47 159.93 18.27 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.107 -0.497 . . . . 2.21 112.269 174.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 509' ' ' HIS . . . . . 0.405 ' HD2' ' HB2' ' B' ' 511' ' ' GLU . 82.3 t60 -69.7 134.24 48.43 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 109.14 -0.689 . . . . 2.6699999999999999 109.14 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 510' ' ' GLU . . . . . 0.486 ' HG2' ' HE2' ' B' ' 514' ' ' LYS . 40.6 tt0 -41.65 -35.43 0.76 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 113.375 0.88 . . . . 2.6600000000000001 113.375 -173.243 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 511' ' ' GLU . . . . . 0.405 ' HB2' ' HD2' ' B' ' 509' ' ' HIS . 0.6 OUTLIER -73.73 -42.03 61.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.621 -0.718 . . . . 2.4399999999999999 112.118 -176.587 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -64.84 -40.1 94.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.129 0.49 . . . . 2.0800000000000001 110.855 171.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 513' ' ' GLU . . . . . 0.411 ' O ' ' HG ' ' B' ' 517' ' ' LEU . 36.4 tt0 -53.72 -48.65 69.39 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.369 -0.832 . . . . 1.9199999999999999 111.183 177.36 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 514' ' ' LYS . . . . . 0.487 ' O ' HG23 ' B' ' 518' ' ' VAL . 66.3 mttm -54.84 -57.56 11.1 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 111.93 0.345 . . . . 2.73 111.93 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -56.66 -35.84 68.86 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 124.157 0.911 . . . . 3.75 111.116 -177.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -76.26 -45.51 32.35 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.121 -0.945 . . . . 1.8899999999999999 110.502 -173.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 517' ' ' LEU . . . . . 0.608 ' HA ' HG12 ' B' ' 520' ' ' VAL . 91.0 mt -66.77 -32.25 73.41 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.757 -0.656 . . . . 1.8999999999999999 112.596 177.156 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 518' ' ' VAL . . . . . 0.487 HG23 ' O ' ' B' ' 514' ' ' LYS . 78.5 t -67.45 -35.15 72.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 118.495 -1.282 . . . . 1.3999999999999999 109.021 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 41.4 p -72.98 -36.26 67.04 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.311 0.577 . . . . 1.1799999999999999 112.401 178.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 520' ' ' VAL . . . . . 0.608 HG12 ' HA ' ' B' ' 517' ' ' LEU . 9.3 p -71.3 -42.37 74.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 116.48 -0.327 . . . . 1.22 111.588 -174.387 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 521' ' ' ILE . . . . . 0.617 HG22 ' CD1' ' B' ' 547' ' ' ILE . 15.5 pt -90.57 -25.82 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 115.455 1.65 . . . . 1.98 115.455 -175.135 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 34.1 ttmt -60.89 -35.16 75.91 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.682 -0.858 . . . . 2.5699999999999998 108.682 173.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -92.45 -21.49 20.15 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 114.988 1.477 . . . . 2.1699999999999999 114.988 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 77.5 mt -70.6 -45.36 65.44 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.295 -0.631 . . . . 1.48 109.295 168.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 83.9 mt -52.3 -45.45 65.54 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.222 0.534 . . . . 1.95 110.942 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.5 -40.54 94.34 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 73.4 mt -63.52 -36.18 82.94 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.033 0.444 . . . . 1.6699999999999999 111.437 175.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 42.3 t -63.47 -47.83 80.19 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.082 -0.508 . . . . 0.58999999999999997 110.63 -175.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.64 -29.6 70.16 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.438 -0.801 . . . . 2.5 112.616 173.832 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -71.72 -54.65 9.59 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.341 0.867 . . . . 2.2400000000000002 113.341 -177.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 17.1 tptp -68.76 137.95 54.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.008 -0.542 . . . . 2.2799999999999998 111.031 -177.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 532' ' ' ARG . . . . . 0.434 ' HA ' ' NZ ' ' B' ' 537' ' ' LYS . 16.3 ptp180 -96.43 160.72 14.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.765 -0.652 . . . . 4.21 110.19 178.384 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.39 119.58 1.34 Allowed Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.918 -0.583 . . . . 0.0 114.018 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -46.99 -36.71 8.07 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.187 0.81 . . . . 2.9500000000000002 113.187 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -50.53 -51.86 43.95 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 120.337 -0.545 . . . . 2.2000000000000002 110.799 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 -66.09 -44.82 83.3 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.621 0.601 . . . . 1.47 112.621 178.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 537' ' ' LYS . . . . . 0.434 ' NZ ' ' HA ' ' B' ' 532' ' ' ARG . 63.1 mttp -67.8 -32.08 72.39 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.468 -0.493 . . . . 2.5 110.258 -174.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.1 -46.93 69.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.835 -0.62 . . . . 0.040000000000000001 111.117 178.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 45.4 mm -58.15 -54.97 25.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 121.622 0.725 . . . . 1.8200000000000001 111.315 173.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 540' ' ' ILE . . . . . . . . . . . . . 82.8 mt -56.73 -48.19 81.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.663 -0.648 . . . . 1.8500000000000001 110.592 -178.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.43 -44.05 84.35 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.577 0.954 . . . . 0.02 113.577 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 542' ' ' SER . . . . . 0.436 ' HA ' ' HG2' ' B' ' 583' ' ' MET . 88.9 p -60.5 -38.78 85.43 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.571 -0.451 . . . . 1.2 110.297 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -68.96 -47.09 66.5 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.407 1.262 . . . . 2.0299999999999998 114.407 -175.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 544' ' ' ILE . . . . . 0.49 ' O ' HG12 ' B' ' 547' ' ' ILE . 61.2 mt -52.67 -45.89 49.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.539 -0.912 . . . . 1.8100000000000001 108.539 170.034 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 545' ' ' MET . . . . . 0.837 ' HB3' HG21 ' B' ' 587' ' ' THR . 0.2 OUTLIER -64.08 -42.31 97.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.693 -0.803 . . . . 2.6000000000000001 112.825 179.389 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -58.19 -48.84 79.06 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 119.197 -1.001 . . . . 2.0800000000000001 109.962 176.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 547' ' ' ILE . . . . . 0.617 ' CD1' HG22 ' B' ' 521' ' ' ILE . 38.1 pt -55.02 -61.43 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.856 0.687 . . . . 1.5 112.856 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 548' ' ' VAL . . . . . 0.446 HG12 ' HA ' ' B' ' 545' ' ' MET . 10.2 p -47.3 -44.26 8.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 C-N-CA 119.784 -0.767 . . . . 1.3999999999999999 111.446 176.197 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.37 -28.07 58.8 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.823 -0.548 . . . . 0.0 112.976 -177.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 550' ' ' GLN . . . . . 0.439 ' HG2' ' HB3' ' B' ' 505' ' ' SER . 47.3 tt0 -87.01 -9.55 55.27 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 112.601 0.593 . . . . 2.27 112.601 -175.327 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -120.48 59.72 7.2 Favored Pre-proline 0 CA--C 1.536 0.44 0 N-CA-C 113.792 1.034 . . . . 3.5299999999999998 113.792 -176.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -55.97 -39.34 91.78 Favored 'Trans proline' 0 C--O 1.222 -0.311 0 O-C-N 122.122 0.538 . . . . 0.46000000000000002 113.246 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 17.0 tpp180 -56.35 -46.66 79.88 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 121.022 0.439 . . . . 3.8700000000000001 109.88 -174.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -49.0 -59.69 3.4 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 123.967 0.907 . . . . 0.69999999999999996 112.098 168.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 555' ' ' LEU . . . . . 0.401 ' HG ' ' CB ' ' B' ' 562' ' ' LEU . 4.7 tp -54.33 -48.64 71.15 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 116.272 -0.422 . . . . 1.49 110.219 -179.015 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 556' ' ' ARG . . . . . 0.597 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 64.9 ttt180 -53.84 -35.93 62.01 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 113.739 1.015 . . . . 3.0899999999999999 113.739 -178.228 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.06 -12.16 50.89 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.486 -0.486 . . . . 0.0 112.047 -177.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -128.24 78.56 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 2.9300000000000002 114.388 -177.571 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.57 -48.25 57.59 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.55 2.055 . . . . 3.1099999999999999 116.55 -176.041 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 560' ' ' LYS . . . . . 0.459 ' O ' HG23 ' B' ' 564' ' ' THR . 75.6 mmtt -56.68 -36.65 69.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 3.3199999999999998 111.121 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 561' ' ' PHE . . . . . 0.457 ' O ' HG23 ' B' ' 565' ' ' VAL . 1.2 t80 -74.82 -45.09 45.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.142 -1.023 . . . . 1.25 112.009 175.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 562' ' ' LEU . . . . . 0.532 HD21 ' HE1' ' B' ' 599' ' ' PHE . 9.6 tt -50.07 -59.04 4.29 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.597 -0.274 . . . . 1.3200000000000001 110.306 175.04 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -50.26 -38.62 41.78 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.805 1.039 . . . . 2.7400000000000002 113.805 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 564' ' ' THR . . . . . 0.459 HG23 ' O ' ' B' ' 560' ' ' LYS . 26.1 p -71.76 -39.43 70.01 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.534 0.683 . . . . 1.24 110.38 -176.071 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 565' ' ' VAL . . . . . 0.457 HG23 ' O ' ' B' ' 561' ' ' PHE . 95.7 t -62.8 -41.37 92.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.577 -0.738 . . . . 1.1899999999999999 112.511 173.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 566' ' ' VAL . . . . . 0.559 HG22 HD12 ' B' ' 591' ' ' ILE . 46.3 t -70.99 -50.87 39.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 120.621 -0.432 . . . . 1.3600000000000001 110.795 -176.489 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -51.11 -37.43 45.93 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.075 -0.511 . . . . 1.9399999999999999 111.987 170.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -72.67 -32.63 65.96 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.733 -0.469 . . . . 3.5299999999999998 109.733 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 569' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' B' ' 565' ' ' VAL . 54.1 mt -67.51 -36.47 81.11 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 108.703 -0.851 . . . . 2.0099999999999998 108.703 177.072 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 570' ' ' PHE . . . . . 0.456 ' HD1' HG23 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.39 -39.43 92.21 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.851 -0.425 . . . . 3.77 109.851 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -57.52 -53.64 55.89 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 119.97 -0.692 . . . . 2.4700000000000002 110.52 176.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -62.36 -9.99 9.9 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 114.092 1.145 . . . . 1.23 114.092 -177.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 573' ' ' MET . . . . . 0.842 ' HB3' HD21 ' B' ' 625' ' ' LEU . 89.5 mtp -76.35 -5.37 46.84 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.614 0.721 . . . . 2.1099999999999999 109.641 178.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 60.6 m80 -109.39 -0.59 18.92 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.78 -1.1 . . . . 3.2000000000000002 111.465 173.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 575' ' ' GLU . . . . . 0.616 ' CG ' HG11 ' B' ' 580' ' ' VAL . 8.1 tp10 -68.46 130.18 42.11 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.193 -0.458 . . . . 1.55 110.162 177.495 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 72.4 p -87.84 -21.35 25.08 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 112.991 0.737 . . . . 1.3999999999999999 112.991 -177.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 577' ' ' HIS . . . . . 0.781 ' O ' HG12 ' B' ' 580' ' ' VAL . 11.8 t60 -60.2 128.03 34.76 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.364 0.602 . . . . 2.8500000000000001 112.596 -175.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -44.9 125.88 5.4 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.388 -0.824 . . . . 2.1499999999999999 113.103 -171.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.19 -34.65 4.81 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 116.207 1.243 . . . . 0.0 116.207 174.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 580' ' ' VAL . . . . . 0.781 HG12 ' O ' ' B' ' 577' ' ' HIS . 13.4 p -53.75 -46.34 62.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.154 0.798 . . . . 1.29 113.154 -175.526 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.525 ' N ' HG13 ' B' ' 580' ' ' VAL . 10.9 pt20 -59.67 -42.29 92.56 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.365 0.506 . . . . 1.99 112.365 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -60.56 -42.36 96.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 112.243 0.461 . . . . 2.23 112.243 172.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 583' ' ' MET . . . . . 0.436 ' HG2' ' HA ' ' B' ' 542' ' ' SER . 40.0 tpp -60.71 -49.45 77.47 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 121.126 -0.229 . . . . 2.5800000000000001 110.432 175.501 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.83 -43.06 80.68 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.196 -0.456 . . . . 0.029999999999999999 111.634 -177.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 52.2 t -74.32 -40.92 61.9 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 119.997 -0.681 . . . . 1.5 112.025 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -59.55 -46.41 88.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.415 . . . . 1.98 111.886 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 587' ' ' THR . . . . . 0.837 HG21 ' HB3' ' B' ' 545' ' ' MET . 81.4 p -62.16 -41.22 98.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.3 110.43 175.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 588' ' ' PHE . . . . . 0.545 ' HA ' HG12 ' B' ' 591' ' ' ILE . 88.7 t80 -61.5 -32.09 72.11 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.085 -0.507 . . . . 0.53000000000000003 111.189 -177.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 589' ' ' ILE . . . . . . . . . . . . . 48.5 mm -79.99 -35.87 16.4 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.89 -1.924 . . . . 1.97 109.806 -175.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -57.56 -50.01 74.5 Favored 'General case' 0 C--O 1.221 -0.438 0 N-CA-C 107.756 -1.201 . . . . 2.6200000000000001 107.756 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 591' ' ' ILE . . . . . 0.559 HD12 HG22 ' B' ' 566' ' ' VAL . 37.1 pt -63.74 -43.72 98.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.688 -0.687 . . . . 1.96 112.802 -177.029 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 592' ' ' ALA . . . . . 0.491 ' N ' HG13 ' B' ' 591' ' ' ILE . . . -63.96 -39.13 93.43 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.494 -0.482 . . . . 0.0 112.261 177.631 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -62.41 -70.02 0.22 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 119.096 -1.041 . . . . 2.3599999999999999 109.807 174.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -56.12 -23.82 36.72 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 116.587 2.069 . . . . 2.1899999999999999 116.587 -176.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.3 p -121.61 25.14 9.47 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 114.247 1.203 . . . . 1.26 114.247 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 596' ' ' ARG . . . . . 0.423 ' HE ' ' HA ' ' B' ' 596' ' ' ARG . 0.0 OUTLIER -48.5 -38.6 20.57 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.824 1.787 . . . . 3.5800000000000001 115.824 -172.404 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 597' ' ' ARG . . . . . 0.424 ' O ' HG12 ' B' ' 600' ' ' VAL . 24.1 tpp180 -69.48 -32.62 71.62 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.214 0.82 . . . . 3.7400000000000002 113.214 -175.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 598' ' ' HIS . . . . . 0.597 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 57.5 m-70 -70.15 -3.9 18.93 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.619 -0.719 . . . . 2.1400000000000001 112.05 -173.558 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 599' ' ' PHE . . . . . 0.532 ' HE1' HD21 ' B' ' 562' ' ' LEU . 6.1 m-85 -105.51 -16.96 14.57 Favored 'General case' 0 CA--C 1.516 -0.329 0 O-C-N 123.669 0.606 . . . . 2.9500000000000002 110.268 -176.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 600' ' ' VAL . . . . . 0.424 HG12 ' O ' ' B' ' 597' ' ' ARG . 9.3 p -105.84 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.039 -0.982 . . . . 1.4199999999999999 111.325 -175.664 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -101.95 139.53 37.46 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.547 -0.861 . . . . 2.3399999999999999 111.601 176.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 5.7 p -60.91 122.76 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.489 0 N-CA-C 108.577 -0.898 . . . . 1.3700000000000001 108.577 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -92.83 167.34 11.91 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 123.705 0.628 . . . . 2.6800000000000002 110.051 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 17.3 m -71.93 128.96 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 N-CA-C 112.981 0.734 . . . . 1.27 112.981 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.38 6.51 64.4 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.082 -175.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -131.55 158.04 42.0 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.555 -0.858 . . . . 2.5099999999999998 110.766 175.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 31.5 m -103.24 -22.56 4.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.093 -0.958 . . . . 1.3999999999999999 112.507 -175.128 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 608' ' ' MET . . . . . 0.46 ' HG3' ' HD2' ' B' ' 609' ' ' PRO . 59.6 ttp -136.99 142.26 37.79 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.643 0.609 . . . . 2.6800000000000002 112.643 -174.258 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 609' ' ' PRO . . . . . 0.46 ' HD2' ' HG3' ' B' ' 608' ' ' MET . 68.9 Cg_exo -52.09 130.92 37.03 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.928 1.085 . . . . 0.42999999999999999 112.094 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -57.01 -31.86 65.54 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.792 0.293 . . . . 2.3700000000000001 111.792 -174.138 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 611' ' ' ILE . . . . . 0.419 HG23 ' N ' ' B' ' 612' ' ' ASP . 14.0 tt -50.06 -44.75 22.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.814 0.34 . . . . 1.8400000000000001 110.592 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 612' ' ' ASP . . . . . 0.419 ' N ' HG23 ' B' ' 611' ' ' ILE . 20.8 m-20 -49.92 -52.11 35.7 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.632 0.773 . . . . 2.1499999999999999 112.854 177.642 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -59.84 -37.14 78.39 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.612 -0.435 . . . . 2.6600000000000001 110.21 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 41.6 mm -64.49 -48.04 86.71 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 120.169 -0.612 . . . . 1.76 111.946 178.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.57 -31.13 71.88 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.012 0.745 . . . . 1.8400000000000001 113.012 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -79.55 2.1 23.46 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.569 1.322 . . . . 2.0600000000000001 114.569 -179.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 36.5 p30 -142.42 15.59 2.02 Favored 'General case' 0 C--O 1.242 0.685 0 N-CA-C 113.143 0.794 . . . . 1.97 113.143 -174.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 618' ' ' ILE . . . . . 0.453 HG23 ' N ' ' B' ' 619' ' ' ASN . 10.7 tt -46.9 -46.99 8.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.0099999999999998 110.222 -176.671 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 619' ' ' ASN . . . . . 0.453 ' N ' HG23 ' B' ' 618' ' ' ILE . 45.4 t-20 -63.23 -51.06 67.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.754 1.02 . . . . 2.2799999999999998 113.754 -176.409 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 73.3 p -56.89 -31.88 65.31 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 119.455 -0.898 . . . . 1.3200000000000001 110.782 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 621' ' ' ILE . . . . . 0.456 HG23 ' HD1' ' B' ' 570' ' ' PHE . 17.7 mt -79.33 -42.64 23.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.334 1.605 . . . . 2.0 115.334 -179.018 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 622' ' ' ILE . . . . . 0.67 ' HA ' HD23 ' B' ' 625' ' ' LEU . 14.3 mt -87.69 -6.22 10.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.055 1.502 . . . . 2.0899999999999999 115.055 -177.67 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 44.1 t -20.0 -58.34 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 116.529 2.048 . . . . 1.47 116.529 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -99.21 -7.58 26.3 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.977 -1.465 . . . . 2.0699999999999998 111.027 -163.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 625' ' ' LEU . . . . . 0.842 HD21 ' HB3' ' B' ' 573' ' ' MET . 3.6 mm? -71.97 146.86 47.47 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.443 -0.344 . . . . 1.6699999999999999 111.689 -173.568 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 626' ' ' GLN . . . . . 0.642 ' O ' HG23 ' B' ' 630' ' ' VAL . 47.5 mt-30 -76.68 162.0 72.13 Favored Pre-proline 0 CA--C 1.519 -0.241 0 N-CA-C 108.834 -0.802 . . . . 2.3500000000000001 108.834 174.765 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 627' ' ' PRO . . . . . 0.558 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 5.4 Cg_endo -47.71 -43.67 28.12 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 N-CA-C 115.825 1.433 . . . . 0.44 115.825 -178.473 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -67.31 -43.07 82.56 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.563 -0.532 . . . . 2.6200000000000001 109.563 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -63.26 -38.29 90.57 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.946 -0.57 . . . . 2.0600000000000001 110.926 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 630' ' ' VAL . . . . . 0.642 HG23 ' O ' ' B' ' 626' ' ' GLN . 38.6 t . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.316 -0.85 . . . . 1.3 110.695 176.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 504' ' ' ILE . . . . . 0.861 HG12 ' HB3' ' B' ' 507' ' ' ALA . 14.5 tt . . . . . 0 C--O 1.236 0.371 0 N-CA-C 113.098 0.777 . . . . 2.1299999999999999 113.098 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 48.1 m -48.85 119.2 3.01 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.6 0.592 . . . . 1.29 112.6 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.85 1.45 67.75 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.946 -0.645 . . . . 0.0 114.408 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 507' ' ' ALA . . . . . 0.861 ' HB3' HG12 ' B' ' 504' ' ' ILE . . . -94.34 -7.59 41.31 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.646 0.723 . . . . 0.02 112.443 176.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 25.8 mmt -112.4 160.06 18.1 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 121.116 0.484 . . . . 2.21 112.283 174.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -69.76 134.26 48.38 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.085 -0.709 . . . . 2.6699999999999999 109.085 174.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 510' ' ' GLU . . . . . 0.606 ' HB2' HH21 ' B' ' 553' ' ' ARG . 39.7 tt0 -41.68 -35.47 0.78 Allowed 'General case' 0 C--O 1.24 0.598 0 N-CA-C 113.394 0.887 . . . . 2.6600000000000001 113.394 -173.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -73.73 -41.94 61.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.515 -0.766 . . . . 2.4399999999999999 112.117 -176.525 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -64.79 -40.16 94.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.178 0.513 . . . . 2.0800000000000001 110.878 171.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 513' ' ' GLU . . . . . 0.476 ' O ' HD13 ' B' ' 517' ' ' LEU . 45.0 tt0 -53.76 -48.62 69.56 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.344 -0.843 . . . . 1.9199999999999999 111.091 177.455 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 514' ' ' LYS . . . . . 0.416 ' O ' HG13 ' B' ' 518' ' ' VAL . 24.8 ttpp -54.9 -57.59 11.02 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 111.911 0.337 . . . . 2.73 111.911 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 515' ' ' ARG . . . . . 0.466 ' O ' HG22 ' B' ' 518' ' ' VAL . 37.1 ttm180 -56.6 -35.89 68.77 Favored 'General case' 0 CA--C 1.506 -0.733 0 O-C-N 124.209 0.943 . . . . 3.75 111.127 -177.548 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.498 ' O ' HG23 ' B' ' 520' ' ' VAL . 73.8 t80 -76.11 -45.58 33.11 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.065 -0.971 . . . . 1.8899999999999999 110.515 -173.415 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 517' ' ' LEU . . . . . 0.638 HD21 ' CG ' ' B' ' 551' ' ' TYR . 8.7 mp -66.73 -32.25 73.42 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.755 -0.657 . . . . 1.8999999999999999 112.642 177.151 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 518' ' ' VAL . . . . . 0.466 HG22 ' O ' ' B' ' 515' ' ' ARG . 28.3 m -67.49 -35.1 72.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 118.535 -1.266 . . . . 1.3999999999999999 109.07 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 20.7 p -72.99 -36.31 67.03 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.393 0.616 . . . . 1.1799999999999999 112.408 178.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 520' ' ' VAL . . . . . 0.498 HG23 ' O ' ' B' ' 516' ' ' PHE . 54.5 t -71.23 -42.29 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 122.133 -0.354 . . . . 1.22 111.703 -174.427 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 521' ' ' ILE . . . . . 0.515 ' O ' HD13 ' B' ' 525' ' ' LEU . 2.3 pp -90.68 -25.83 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.442 1.645 . . . . 1.98 115.442 -175.158 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 6.1 tmmm? -60.75 -35.24 75.89 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.712 -0.847 . . . . 2.5699999999999998 108.712 173.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -92.42 -21.53 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.979 1.474 . . . . 2.1699999999999999 114.979 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 38.4 mt -70.58 -45.43 65.37 Favored 'General case' 0 C--O 1.218 -0.588 0 N-CA-C 109.313 -0.625 . . . . 1.48 109.313 168.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 525' ' ' LEU . . . . . 0.635 HD12 HD13 ' B' ' 544' ' ' ILE . 7.5 mp -52.19 -45.43 65.15 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.197 0.522 . . . . 1.95 110.978 169.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 526' ' ' GLY . . . . . 0.455 ' O ' ' HG2' ' B' ' 529' ' ' GLU . . . -66.51 -40.63 94.33 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 -178.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 47.0 mt -63.52 -36.07 82.57 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 1.6699999999999999 111.47 175.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 528' ' ' CYS . . . . . 0.518 ' HB2' HG21 ' B' ' 540' ' ' ILE . 49.5 t -63.54 -47.7 80.55 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.08 -0.509 . . . . 0.58999999999999997 110.662 -175.269 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 529' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' B' ' 526' ' ' GLY . 13.0 pt-20 -61.8 -29.58 70.25 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.44 -0.8 . . . . 2.5 112.542 173.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -71.68 -54.64 9.67 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.376 0.88 . . . . 2.2400000000000002 113.376 -177.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 531' ' ' LYS . . . . . 0.46 ' O ' ' HD2' ' B' ' 537' ' ' LYS . 67.6 mttm -68.8 137.95 54.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.964 -0.562 . . . . 2.2799999999999998 111.119 -177.494 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -96.46 160.7 14.27 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.811 -0.631 . . . . 4.21 110.231 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.5 119.57 1.36 Allowed Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 115.905 -0.589 . . . . 0.0 114.019 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 534' ' ' LYS . . . . . 0.462 ' HD3' ' N ' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.11 -36.65 8.61 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.176 0.806 . . . . 2.9500000000000002 113.176 177.274 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -50.51 -51.92 43.22 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.382 -0.527 . . . . 2.2000000000000002 110.828 174.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 536' ' ' ASN . . . . . 0.479 ' O ' HD13 ' B' ' 540' ' ' ILE . 93.3 m-20 -65.98 -44.85 83.66 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.697 0.628 . . . . 1.47 112.697 178.265 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 537' ' ' LYS . . . . . 0.46 ' HD2' ' O ' ' B' ' 531' ' ' LYS . 0.0 OUTLIER -67.78 -31.97 72.23 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.375 -0.53 . . . . 2.5 110.368 -174.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.2 -46.95 69.21 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.79 -0.641 . . . . 0.040000000000000001 111.079 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 85.9 mt -58.1 -54.98 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.558 0.694 . . . . 1.8200000000000001 111.295 173.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 540' ' ' ILE . . . . . 0.518 HG21 ' HB2' ' B' ' 528' ' ' CYS . 1.7 mp -56.82 -48.04 81.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.719 -0.613 . . . . 1.8500000000000001 110.632 -178.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 541' ' ' ALA . . . . . 0.5 ' O ' ' HG2' ' B' ' 545' ' ' MET . . . -57.44 -44.21 84.55 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 113.514 0.931 . . . . 0.02 113.514 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 90.7 p -60.36 -38.78 84.94 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.601 -0.44 . . . . 1.2 110.271 -178.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 543' ' ' ASN . . . . . 0.442 ' O ' HG12 ' B' ' 547' ' ' ILE . 53.3 t30 -69.06 -47.06 66.28 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 114.362 1.245 . . . . 2.0299999999999998 114.362 -175.228 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 544' ' ' ILE . . . . . 0.635 HD13 HD12 ' B' ' 525' ' ' LEU . 23.1 mt -52.66 -45.89 48.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.539 -0.912 . . . . 1.8100000000000001 108.539 170.031 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 545' ' ' MET . . . . . 0.779 ' HB3' HG21 ' B' ' 587' ' ' THR . 33.4 mmt -64.05 -42.33 97.07 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 119.659 -0.816 . . . . 2.6000000000000001 112.833 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -58.28 -48.77 79.41 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 119.189 -1.004 . . . . 2.0800000000000001 109.893 176.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 547' ' ' ILE . . . . . 0.442 HG12 ' O ' ' B' ' 543' ' ' ASN . 43.3 mm -55.06 -61.48 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.77 0.656 . . . . 1.5 112.77 179.184 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 548' ' ' VAL . . . . . 0.718 HG13 HD11 ' B' ' 555' ' ' LEU . 97.9 t -47.3 -44.27 8.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 119.817 -0.753 . . . . 1.3999999999999999 111.427 176.278 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.02 58.81 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.791 -0.568 . . . . 0.0 112.934 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -87.05 -9.55 55.21 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.629 0.604 . . . . 2.27 112.629 -175.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 551' ' ' TYR . . . . . 0.638 ' CG ' HD21 ' B' ' 517' ' ' LEU . 84.7 m-85 -120.45 59.69 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.798 1.036 . . . . 3.5299999999999998 113.798 -176.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -55.97 -39.36 91.65 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 O-C-N 122.183 0.57 . . . . 0.46000000000000002 113.162 177.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 553' ' ' ARG . . . . . 0.606 HH21 ' HB2' ' B' ' 510' ' ' GLU . 11.2 ptm180 -56.33 -46.72 79.77 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 121.147 0.499 . . . . 3.8700000000000001 109.935 -174.171 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -48.96 -59.72 3.37 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.927 0.891 . . . . 0.69999999999999996 112.12 167.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 555' ' ' LEU . . . . . 0.718 HD11 HG13 ' B' ' 548' ' ' VAL . 11.1 mp -54.39 -48.49 71.49 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 116.305 -0.407 . . . . 1.49 110.177 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -53.94 -35.88 62.19 Favored 'General case' 0 C--O 1.242 0.682 0 N-CA-C 113.791 1.034 . . . . 3.0899999999999999 113.791 -178.272 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.1 -12.16 50.78 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.458 -0.497 . . . . 0.0 112.047 -177.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 17.4 t-160 -128.26 78.51 1.84 Allowed 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.456 1.28 . . . . 2.9300000000000002 114.456 -177.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -50.48 -48.26 56.76 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 116.584 2.068 . . . . 3.1099999999999999 116.584 -176.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 560' ' ' LYS . . . . . 0.426 ' O ' HG23 ' B' ' 564' ' ' THR . 4.7 tppp? -56.71 -36.65 69.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.325 -0.398 . . . . 3.3199999999999998 111.099 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 561' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -74.84 -45.14 45.21 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.095 -1.042 . . . . 1.25 111.916 175.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 562' ' ' LEU . . . . . 0.557 ' O ' HG12 ' B' ' 565' ' ' VAL . 6.3 tt -49.99 -59.15 4.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.529 0.332 . . . . 1.3200000000000001 110.226 175.087 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -50.21 -38.54 40.71 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.912 1.079 . . . . 2.7400000000000002 113.912 178.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 564' ' ' THR . . . . . 0.426 HG23 ' O ' ' B' ' 560' ' ' LYS . 24.0 p -71.92 -39.31 69.56 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.498 0.666 . . . . 1.24 110.371 -176.099 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 565' ' ' VAL . . . . . 0.689 HG21 HG11 ' B' ' 548' ' ' VAL . 0.3 OUTLIER -62.83 -41.24 91.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.676 -0.693 . . . . 1.1899999999999999 112.543 173.361 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 566' ' ' VAL . . . . . . . . . . . . . 85.2 t -71.11 -50.83 39.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 C-N-CA 120.519 -0.473 . . . . 1.3600000000000001 110.845 -176.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 15.1 m-80 -51.09 -37.42 45.63 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.965 -0.562 . . . . 1.9399999999999999 112.01 170.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 36.1 mmtm -72.58 -32.76 66.26 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.701 -0.481 . . . . 3.5299999999999998 109.701 -179.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 569' ' ' LEU . . . . . 0.432 HD13 ' O ' ' B' ' 565' ' ' VAL . 4.3 mp -67.45 -36.51 81.34 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 108.737 -0.838 . . . . 2.0099999999999998 108.737 177.159 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 570' ' ' PHE . . . . . 0.602 ' HA ' HD11 ' B' ' 621' ' ' ILE . 18.2 m-30 -65.29 -39.35 92.41 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.915 -0.402 . . . . 3.77 109.915 178.284 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.448 ' O ' ' ND1' ' B' ' 574' ' ' HIS . 36.8 tt0 -57.74 -53.44 58.16 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 119.921 -0.711 . . . . 2.4700000000000002 110.508 176.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -62.43 -10.0 10.15 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.11 1.152 . . . . 1.23 114.11 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 573' ' ' MET . . . . . 0.5 ' HB3' HD21 ' B' ' 625' ' ' LEU . 54.9 mtt -76.4 -5.31 46.73 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.703 0.763 . . . . 2.1099999999999999 109.646 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 574' ' ' HIS . . . . . 0.448 ' ND1' ' O ' ' B' ' 571' ' ' GLU . 0.0 OUTLIER -109.48 -0.51 18.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.729 -1.123 . . . . 3.2000000000000002 111.434 173.792 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 575' ' ' GLU . . . . . 0.411 ' HG2' HG11 ' B' ' 580' ' ' VAL . 9.7 tp10 -68.51 130.18 42.11 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 116.217 -0.447 . . . . 1.55 110.094 177.482 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 3.9 t -87.79 -21.31 25.18 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.984 0.735 . . . . 1.3999999999999999 112.984 -177.255 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 30.2 m80 -60.11 128.03 34.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.385 0.612 . . . . 2.8500000000000001 112.597 -175.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -44.92 125.84 5.39 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.372 -0.831 . . . . 2.1499999999999999 113.132 -171.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.3 -34.74 4.77 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.203 1.241 . . . . 0.0 116.203 174.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 580' ' ' VAL . . . . . 0.411 HG11 ' HG2' ' B' ' 575' ' ' GLU . 47.5 t -53.67 -46.36 61.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.195 0.813 . . . . 1.29 113.195 -175.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 22.2 pt20 -59.72 -42.22 92.6 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.406 0.521 . . . . 1.99 112.406 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.54 -42.43 96.52 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.155 0.428 . . . . 2.23 112.155 172.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 90.8 mmm -60.72 -49.46 77.41 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.069 -0.252 . . . . 2.5800000000000001 110.43 175.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.78 -43.0 80.41 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.154 -0.475 . . . . 0.029999999999999999 111.664 -177.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 585' ' ' CYS . . . . . 0.434 ' O ' HG12 ' B' ' 589' ' ' ILE . 52.7 t -74.38 -40.99 61.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 120.042 -0.663 . . . . 1.5 111.912 -177.246 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -59.58 -46.34 89.21 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.316 -0.402 . . . . 1.98 111.95 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 587' ' ' THR . . . . . 0.779 HG21 ' HB3' ' B' ' 545' ' ' MET . 36.4 p -62.15 -41.26 98.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.3 110.366 175.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -61.41 -32.25 72.19 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.147 -0.478 . . . . 0.53000000000000003 111.129 -177.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 589' ' ' ILE . . . . . 0.434 HG12 ' O ' ' B' ' 585' ' ' CYS . 50.3 mm -79.88 -36.02 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 C-N-CA 116.902 -1.919 . . . . 1.97 109.775 -175.339 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 590' ' ' LYS . . . . . 0.403 ' NZ ' ' HA ' ' B' ' 587' ' ' THR . 36.8 mtmm -57.4 -50.01 74.35 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 107.75 -1.204 . . . . 2.6200000000000001 107.75 176.098 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 83.9 mt -63.84 -43.76 97.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.697 -0.683 . . . . 1.96 112.726 -176.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.96 -39.1 93.37 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.425 -0.51 . . . . 0.0 112.285 177.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -62.38 -70.04 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 119.096 -1.041 . . . . 2.3599999999999999 109.815 174.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -56.16 -23.72 36.66 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 116.596 2.073 . . . . 2.1899999999999999 116.596 -176.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 82.8 m -121.71 25.14 9.42 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 114.241 1.2 . . . . 1.26 114.241 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -48.52 -38.47 20.4 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.835 1.791 . . . . 3.5800000000000001 115.835 -172.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -69.7 -32.54 71.19 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.212 0.819 . . . . 3.7400000000000002 113.212 -175.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 55.3 m80 -70.16 -3.77 18.36 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.593 -0.731 . . . . 2.1400000000000001 112.08 -173.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -105.53 -17.01 14.55 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.564 0.54 . . . . 2.9500000000000002 110.241 -176.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 21.6 t -105.82 -24.37 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.025 -0.989 . . . . 1.4199999999999999 111.327 -175.646 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -101.97 139.49 37.53 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 119.566 -0.854 . . . . 2.3399999999999999 111.576 176.371 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 11.8 m -60.85 122.69 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.671 -0.863 . . . . 1.3700000000000001 108.671 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -92.75 167.3 11.97 Favored 'General case' 0 C--O 1.225 -0.213 0 O-C-N 123.659 0.599 . . . . 2.6800000000000002 110.111 -177.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 34.9 t -71.94 128.96 35.47 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 N-CA-C 112.949 0.722 . . . . 1.27 112.949 -175.206 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.33 6.59 64.42 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.11 -175.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -131.53 157.99 42.12 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.565 -0.854 . . . . 2.5099999999999998 110.745 175.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 29.2 t -103.2 -22.62 4.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.029 -0.987 . . . . 1.3999999999999999 112.496 -175.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 608' ' ' MET . . . . . . . . . . . . . 66.0 mtm -136.91 142.25 37.87 Favored Pre-proline 0 C--O 1.223 -0.302 0 N-CA-C 112.626 0.602 . . . . 2.6800000000000002 112.626 -174.206 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 609' ' ' PRO . . . . . 0.543 ' HB2' HG22 ' B' ' 611' ' ' ILE . 9.6 Cg_endo -52.08 130.88 36.85 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.845 1.03 . . . . 0.42999999999999999 112.131 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -57.02 -31.79 65.49 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.826 0.306 . . . . 2.3700000000000001 111.826 -174.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 611' ' ' ILE . . . . . 0.543 HG22 ' HB2' ' B' ' 609' ' ' PRO . 5.9 tp -50.1 -44.74 22.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 120.782 0.325 . . . . 1.8400000000000001 110.577 178.23 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 612' ' ' ASP . . . . . 0.411 ' N ' HG23 ' B' ' 611' ' ' ILE . 16.7 t70 -49.9 -52.12 35.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.632 0.773 . . . . 2.1499999999999999 112.855 177.612 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 613' ' ' GLU . . . . . 0.553 ' HA ' ' ND2' ' B' ' 616' ' ' ASN . 45.7 mt-10 -59.86 -37.03 78.16 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 120.512 -0.475 . . . . 2.6600000000000001 110.231 179.493 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 62.1 mt -64.58 -48.03 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 120.149 -0.62 . . . . 1.76 111.907 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.63 -31.13 71.93 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.959 0.725 . . . . 1.8400000000000001 112.959 -177.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 616' ' ' ASN . . . . . 0.553 ' ND2' ' HA ' ' B' ' 613' ' ' GLU . 20.6 p30 -79.57 2.15 23.33 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.559 1.318 . . . . 2.0600000000000001 114.559 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -142.43 15.67 2.02 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 113.114 0.783 . . . . 1.97 113.114 -174.229 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 618' ' ' ILE . . . . . 0.542 ' O ' HG22 ' B' ' 621' ' ' ILE . 5.0 tp -46.95 -47.01 8.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 C-N-CA 118.973 -1.091 . . . . 2.0099999999999998 110.135 -176.66 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 619' ' ' ASN . . . . . 0.426 ' N ' HG23 ' B' ' 618' ' ' ILE . 41.5 t-20 -63.23 -51.07 67.72 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 113.749 1.018 . . . . 2.2799999999999998 113.749 -176.345 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 72.6 p -56.9 -31.93 65.39 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.455 -0.898 . . . . 1.3200000000000001 110.737 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 621' ' ' ILE . . . . . 0.602 HD11 ' HA ' ' B' ' 570' ' ' PHE . 0.4 OUTLIER -79.32 -42.54 23.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 115.362 1.615 . . . . 2.0 115.362 -178.982 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 622' ' ' ILE . . . . . 0.409 HG12 ' O ' ' B' ' 618' ' ' ILE . 37.6 pt -87.73 -6.27 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.037 1.495 . . . . 2.0899999999999999 115.037 -177.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 54.0 t -19.9 -58.33 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 116.642 2.09 . . . . 1.47 116.642 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -99.29 -7.56 26.18 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.028 -1.442 . . . . 2.0699999999999998 110.989 -163.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 625' ' ' LEU . . . . . 0.5 HD21 ' HB3' ' B' ' 573' ' ' MET . 93.7 mt -71.94 146.93 47.46 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.295 0.372 . . . . 1.6699999999999999 111.694 -173.623 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 626' ' ' GLN . . . . . 0.714 ' O ' HG13 ' B' ' 630' ' ' VAL . 17.3 mp0 -76.74 162.1 71.65 Favored Pre-proline 0 N--CA 1.463 0.189 0 N-CA-C 108.776 -0.824 . . . . 2.3500000000000001 108.776 174.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 627' ' ' PRO . . . . . 0.757 ' O ' HG22 ' B' ' 630' ' ' VAL . 79.4 Cg_exo -47.81 -43.56 28.89 Favored 'Trans proline' 0 CA--C 1.529 0.243 0 N-CA-C 115.856 1.445 . . . . 0.44 115.856 -178.458 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -67.36 -43.02 82.47 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.608 -0.516 . . . . 2.6200000000000001 109.608 -174.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -63.28 -38.33 90.72 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.929 -0.578 . . . . 2.0600000000000001 110.831 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 630' ' ' VAL . . . . . 0.757 HG22 ' O ' ' B' ' 627' ' ' PRO . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.353 -0.832 . . . . 1.3 110.661 176.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 504' ' ' ILE . . . . . 0.937 HG13 ' HB3' ' B' ' 507' ' ' ALA . 7.6 tp . . . . . 0 C--O 1.235 0.309 0 N-CA-C 113.076 0.769 . . . . 2.1299999999999999 113.076 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 80.0 p -48.91 119.12 2.97 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.53 0.567 . . . . 1.29 112.53 174.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.9 1.39 67.67 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 120.964 -0.636 . . . . 0.0 114.37 -179.067 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 507' ' ' ALA . . . . . 0.937 ' HB3' HG13 ' B' ' 504' ' ' ILE . . . -94.29 -7.56 41.57 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 117.736 0.768 . . . . 0.02 112.405 176.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -112.49 160.02 18.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.191 0.519 . . . . 2.21 112.186 174.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -69.78 134.14 48.23 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.131 -0.692 . . . . 2.6699999999999999 109.131 174.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -41.57 -35.46 0.73 Allowed 'General case' 0 C--O 1.24 0.567 0 N-CA-C 113.421 0.897 . . . . 2.6600000000000001 113.421 -173.235 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.78 -41.96 61.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.505 -0.771 . . . . 2.4399999999999999 112.082 -176.548 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.87 -40.04 94.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.133 0.492 . . . . 2.0800000000000001 110.893 171.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -53.66 -48.76 69.12 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.387 -0.824 . . . . 1.9199999999999999 111.102 177.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 514' ' ' LYS . . . . . 0.46 ' O ' HG23 ' B' ' 518' ' ' VAL . 7.3 mtpm? -54.77 -57.67 10.62 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 111.869 0.322 . . . . 2.73 111.869 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 515' ' ' ARG . . . . . 0.403 ' O ' HG23 ' B' ' 519' ' ' THR . 61.3 ttp180 -56.59 -35.96 68.82 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.173 0.921 . . . . 3.75 111.086 -177.478 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.571 ' O ' HG23 ' B' ' 520' ' ' VAL . 62.5 t80 -76.09 -45.6 33.16 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.159 -0.928 . . . . 1.8899999999999999 110.514 -173.358 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 517' ' ' LEU . . . . . 0.417 ' O ' HG22 ' B' ' 521' ' ' ILE . 13.7 tp -66.74 -32.25 73.43 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.731 -0.668 . . . . 1.8999999999999999 112.615 177.139 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 518' ' ' VAL . . . . . 0.515 ' O ' ' HB2' ' B' ' 522' ' ' LYS . 69.3 t -67.5 -35.13 72.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 118.58 -1.248 . . . . 1.3999999999999999 109.081 178.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 519' ' ' THR . . . . . 0.403 HG23 ' O ' ' B' ' 515' ' ' ARG . 74.1 p -72.94 -36.37 67.19 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.1799999999999999 112.413 178.473 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 520' ' ' VAL . . . . . 0.571 HG23 ' O ' ' B' ' 516' ' ' PHE . 67.0 t -71.14 -42.45 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 116.46 -0.336 . . . . 1.22 111.638 -174.447 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 521' ' ' ILE . . . . . 0.417 HG22 ' O ' ' B' ' 517' ' ' LEU . 17.6 tt -90.65 -25.78 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 115.406 1.632 . . . . 1.98 115.406 -175.028 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 522' ' ' LYS . . . . . 0.515 ' HB2' ' O ' ' B' ' 518' ' ' VAL . 0.3 OUTLIER -60.92 -35.25 76.2 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.599 -0.889 . . . . 2.5699999999999998 108.599 173.6 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -92.4 -21.35 20.27 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.062 1.504 . . . . 2.1699999999999999 115.062 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 68.5 mt -70.64 -45.38 65.26 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.3 -0.63 . . . . 1.48 109.3 168.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.31 -45.4 65.56 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.2 0.524 . . . . 1.95 110.931 169.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.55 -40.47 94.22 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 40.2 mt -63.63 -36.14 82.84 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.043 0.449 . . . . 1.6699999999999999 111.426 175.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 48.1 t -63.47 -47.74 80.54 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.041 -0.527 . . . . 0.58999999999999997 110.648 -175.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -61.8 -29.52 70.21 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.472 -0.786 . . . . 2.5 112.517 173.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -71.71 -54.65 9.61 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.353 0.872 . . . . 2.2400000000000002 113.353 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -68.76 137.94 54.44 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.008 -0.542 . . . . 2.2799999999999998 111.07 -177.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 532' ' ' ARG . . . . . 0.438 ' HA ' ' NZ ' ' B' ' 537' ' ' LYS . 35.8 mmt180 -96.44 160.67 14.28 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.774 -0.648 . . . . 4.21 110.183 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.44 119.67 1.36 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.984 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 534' ' ' LYS . . . . . 0.691 ' H ' ' HD2' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.18 -36.64 8.92 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.207 0.817 . . . . 2.9500000000000002 113.207 177.245 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -50.5 -51.85 43.66 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.413 -0.515 . . . . 2.2000000000000002 110.828 174.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -66.09 -44.85 83.21 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.62 0.6 . . . . 1.47 112.62 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 537' ' ' LYS . . . . . 0.438 ' NZ ' ' HA ' ' B' ' 532' ' ' ARG . 64.6 mttp -67.87 -31.98 72.16 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.272 -174.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.09 -46.99 69.45 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.839 -0.619 . . . . 0.040000000000000001 111.115 178.416 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 75.8 mt -58.12 -55.03 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 121.569 0.699 . . . . 1.8200000000000001 111.194 173.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 540' ' ' ILE . . . . . . . . . . . . . 94.0 mt -56.81 -48.07 81.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.605 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 541' ' ' ALA . . . . . 0.451 ' O ' HG12 ' B' ' 544' ' ' ILE . . . -57.49 -43.99 84.6 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 113.583 0.957 . . . . 0.02 113.583 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 94.8 p -60.46 -38.86 85.54 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.647 -0.421 . . . . 1.2 110.215 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 543' ' ' ASN . . . . . 0.469 ' O ' HG12 ' B' ' 547' ' ' ILE . 49.5 t30 -69.05 -47.05 66.35 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 114.352 1.241 . . . . 2.0299999999999998 114.352 -175.174 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 544' ' ' ILE . . . . . 0.476 HG13 ' N ' ' B' ' 545' ' ' MET . 48.9 pt -52.63 -45.94 48.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.492 -0.929 . . . . 1.8100000000000001 108.492 170.032 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 545' ' ' MET . . . . . 0.476 ' N ' HG13 ' B' ' 544' ' ' ILE . 21.4 mmt -64.03 -42.33 97.12 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.729 -0.788 . . . . 2.6000000000000001 112.818 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -58.3 -48.78 79.41 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 119.181 -1.007 . . . . 2.0800000000000001 109.887 176.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 547' ' ' ILE . . . . . 0.469 HG12 ' O ' ' B' ' 543' ' ' ASN . 42.0 mm -55.06 -61.38 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.823 0.675 . . . . 1.5 112.823 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 548' ' ' VAL . . . . . 0.445 HG22 ' HA ' ' B' ' 545' ' ' MET . 36.0 m -47.44 -44.23 9.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 C-N-CA 119.854 -0.738 . . . . 1.3999999999999999 111.388 176.268 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.03 58.82 Favored Glycine 0 C--O 1.237 0.336 0 O-C-N 121.791 -0.568 . . . . 0.0 112.917 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 550' ' ' GLN . . . . . 0.402 ' O ' ' HG3' ' B' ' 550' ' ' GLN . 6.7 tp60 -87.04 -9.58 55.14 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 112.629 0.604 . . . . 2.27 112.629 -175.356 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 551' ' ' TYR . . . . . 0.427 ' O ' HD13 ' B' ' 555' ' ' LEU . 64.4 m-85 -120.38 59.63 6.95 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 113.857 1.058 . . . . 3.5299999999999998 113.857 -176.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 552' ' ' PRO . . . . . 0.568 ' HG3' ' HG2' ' B' ' 594' ' ' LYS . 15.4 Cg_endo -55.99 -39.35 91.72 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.122 0.538 . . . . 0.46000000000000002 113.115 178.003 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 22.0 tpp180 -56.3 -46.81 79.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.134 0.492 . . . . 3.8700000000000001 109.859 -174.173 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 554' ' ' PHE . . . . . 0.484 ' HD2' HD12 ' B' ' 555' ' ' LEU . 67.8 t80 -48.88 -59.81 3.27 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.935 0.894 . . . . 0.69999999999999996 112.098 168.014 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 555' ' ' LEU . . . . . 0.484 HD12 ' HD2' ' B' ' 554' ' ' PHE . 8.2 mp -54.26 -48.62 70.96 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.303 -0.408 . . . . 1.49 110.219 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -53.83 -35.91 61.96 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.831 1.049 . . . . 3.0899999999999999 113.831 -178.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.03 -12.25 50.76 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.517 -0.473 . . . . 0.0 112.088 -177.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -128.18 78.5 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 2.9300000000000002 114.388 -177.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 22.0 m-90 -50.52 -48.32 57.18 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 116.534 2.05 . . . . 3.1099999999999999 116.534 -176.056 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 560' ' ' LYS . . . . . 0.514 ' HA ' ' HE3' ' B' ' 563' ' ' LYS . 37.8 mtmm -56.48 -36.66 69.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.324 -0.398 . . . . 3.3199999999999998 111.213 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 561' ' ' PHE . . . . . 0.436 ' O ' HG23 ' B' ' 565' ' ' VAL . 0.7 OUTLIER -74.95 -45.07 44.81 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 119.142 -1.023 . . . . 1.25 111.871 175.613 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 562' ' ' LEU . . . . . 0.512 ' O ' HG23 ' B' ' 566' ' ' VAL . 3.9 tp -50.01 -59.15 4.17 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.509 0.324 . . . . 1.3200000000000001 110.258 175.09 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 563' ' ' LYS . . . . . 0.514 ' HE3' ' HA ' ' B' ' 560' ' ' LYS . 19.6 pttp -50.18 -38.66 40.81 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.896 1.073 . . . . 2.7400000000000002 113.896 178.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 62.4 m -71.74 -39.39 70.1 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.562 0.696 . . . . 1.24 110.413 -176.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 565' ' ' VAL . . . . . 0.436 HG23 ' O ' ' B' ' 561' ' ' PHE . 92.2 t -62.84 -41.34 92.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.646 -0.706 . . . . 1.1899999999999999 112.527 173.391 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 566' ' ' VAL . . . . . 0.512 HG23 ' O ' ' B' ' 562' ' ' LEU . 36.2 t -70.93 -50.85 40.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 120.551 -0.46 . . . . 1.3600000000000001 110.924 -176.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -51.11 -37.38 45.67 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.03 -0.532 . . . . 1.9399999999999999 111.987 170.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 568' ' ' LYS . . . . . 0.477 ' HZ3' ' HB2' ' B' ' 568' ' ' LYS . 0.6 OUTLIER -72.72 -32.68 65.89 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.599 -0.519 . . . . 3.5299999999999998 109.599 -179.117 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 569' ' ' LEU . . . . . 0.443 HD23 ' HB2' ' B' ' 588' ' ' PHE . 3.4 mp -67.53 -36.42 80.97 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 108.712 -0.847 . . . . 2.0099999999999998 108.712 177.139 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -65.34 -39.39 92.33 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.899 -0.408 . . . . 3.77 109.899 178.322 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -57.67 -53.46 57.94 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 120.036 -0.665 . . . . 2.4700000000000002 110.521 176.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -62.57 -9.91 10.36 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.018 1.118 . . . . 1.23 114.018 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 573' ' ' MET . . . . . 0.417 ' HG3' ' O ' ' B' ' 569' ' ' LEU . 65.6 mtt -76.36 -5.29 46.56 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.671 0.748 . . . . 2.1099999999999999 109.7 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -109.43 -0.54 18.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.73 -1.123 . . . . 3.2000000000000002 111.465 173.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 575' ' ' GLU . . . . . 0.542 ' CG ' HG11 ' B' ' 580' ' ' VAL . 7.2 tp10 -68.59 130.28 42.38 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.189 -0.46 . . . . 1.55 110.104 177.584 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 62.2 p -87.92 -21.27 25.03 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 113.006 0.743 . . . . 1.3999999999999999 113.006 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 577' ' ' HIS . . . . . 0.773 ' O ' HG12 ' B' ' 580' ' ' VAL . 10.7 t60 -60.2 128.02 34.72 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.418 0.628 . . . . 2.8500000000000001 112.545 -175.375 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -44.83 125.87 5.32 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.38 -0.827 . . . . 2.1499999999999999 113.135 -171.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.23 -34.74 4.75 Favored Glycine 0 C--O 1.223 -0.57 0 N-CA-C 116.254 1.262 . . . . 0.0 116.254 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 580' ' ' VAL . . . . . 0.773 HG12 ' O ' ' B' ' 577' ' ' HIS . 13.6 p -53.82 -46.34 63.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 113.121 0.785 . . . . 1.29 113.121 -175.448 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.524 ' N ' HG13 ' B' ' 580' ' ' VAL . 0.7 OUTLIER -59.67 -42.21 92.37 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.406 0.521 . . . . 1.99 112.406 -179.852 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 582' ' ' ASP . . . . . 0.65 ' HA ' ' NE2' ' B' ' 629' ' ' GLN . 19.3 t70 -60.54 -42.5 96.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.149 0.425 . . . . 2.23 112.149 172.098 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 31.8 mmt -60.66 -49.49 77.29 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 121.109 -0.236 . . . . 2.5800000000000001 110.439 175.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.87 -42.87 80.54 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.176 -0.465 . . . . 0.029999999999999999 111.74 -177.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 44.4 t -74.43 -40.92 61.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 120.009 -0.676 . . . . 1.5 111.957 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.58 -46.31 89.3 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.306 -0.406 . . . . 1.98 111.95 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 41.0 m -62.15 -41.25 98.11 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.329 0.652 . . . . 1.3 110.413 175.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 588' ' ' PHE . . . . . 0.443 ' HB2' HD23 ' B' ' 569' ' ' LEU . 87.0 t80 -61.52 -32.15 72.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.007 -0.542 . . . . 0.53000000000000003 111.125 -177.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 589' ' ' ILE . . . . . . . . . . . . . 47.4 mm -79.86 -36.0 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.871 -1.932 . . . . 1.97 109.8 -175.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -57.44 -50.01 74.39 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 107.713 -1.218 . . . . 2.6200000000000001 107.713 176.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 98.2 mt -63.82 -43.82 98.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 112.786 0.661 . . . . 1.96 112.786 -177.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.83 -39.14 93.52 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 177.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -62.32 -70.14 0.22 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.155 -1.018 . . . . 2.3599999999999999 109.772 174.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 594' ' ' LYS . . . . . 0.568 ' HG2' ' HG3' ' B' ' 552' ' ' PRO . 2.3 mppt? -56.11 -23.84 36.81 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.562 2.06 . . . . 2.1899999999999999 116.562 -176.478 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 83.6 m -121.67 25.22 9.4 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.263 1.209 . . . . 1.26 114.263 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 596' ' ' ARG . . . . . 0.517 ' HA ' ' CE2' ' B' ' 599' ' ' PHE . 34.4 ptt180 -48.52 -38.54 20.57 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.83 1.789 . . . . 3.5800000000000001 115.83 -172.447 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 68.7 mtm180 -69.52 -32.61 71.56 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.214 0.82 . . . . 3.7400000000000002 113.214 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -3.81 18.68 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.577 -0.738 . . . . 2.1400000000000001 112.052 -173.558 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 599' ' ' PHE . . . . . 0.524 ' C ' ' HD1' ' B' ' 599' ' ' PHE . 0.1 OUTLIER -105.62 -16.89 14.57 Favored 'General case' 0 CA--C 1.517 -0.32 0 O-C-N 123.621 0.576 . . . . 2.9500000000000002 110.158 -176.552 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 600' ' ' VAL . . . . . 0.46 ' N ' ' HD1' ' B' ' 599' ' ' PHE . 9.4 p -105.82 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.162 -0.926 . . . . 1.4199999999999999 111.327 -175.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -102.04 139.52 37.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 119.551 -0.86 . . . . 2.3399999999999999 111.596 176.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 3.9 p -60.89 122.74 12.14 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 108.597 -0.89 . . . . 1.3700000000000001 108.597 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -92.76 167.3 11.97 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 123.675 0.609 . . . . 2.6800000000000002 110.086 -177.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 7.4 p -71.94 129.01 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 N-CA-C 112.927 0.714 . . . . 1.27 112.927 -175.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.31 6.53 64.51 Favored Glycine 0 N--CA 1.446 -0.7 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.111 -175.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 606' ' ' GLU . . . . . 0.523 ' HG3' ' H ' ' B' ' 608' ' ' MET . 8.3 tp10 -131.5 158.0 42.04 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.557 -0.857 . . . . 2.5099999999999998 110.746 175.604 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 16.7 t -103.27 -22.55 4.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.032 -0.985 . . . . 1.3999999999999999 112.451 -175.166 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 608' ' ' MET . . . . . 0.523 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 88.2 mtp -136.95 142.28 37.94 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.672 0.619 . . . . 2.6800000000000002 112.672 -174.281 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -52.08 130.88 36.86 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.42999999999999999 112.131 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -57.02 -31.76 65.46 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.826 0.306 . . . . 2.3700000000000001 111.826 -174.158 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 611' ' ' ILE . . . . . 0.518 HG12 ' O ' ' B' ' 599' ' ' PHE . 6.4 pt -50.05 -44.87 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 120.784 0.326 . . . . 1.8400000000000001 110.513 178.217 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 612' ' ' ASP . . . . . 0.436 ' H ' HG13 ' B' ' 611' ' ' ILE . 24.8 m-20 -49.94 -52.01 36.69 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.621 0.769 . . . . 2.1499999999999999 112.844 177.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -59.94 -37.14 78.65 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.613 -0.435 . . . . 2.6600000000000001 110.175 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 65.2 mt -64.51 -48.02 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.214 -0.594 . . . . 1.76 111.961 178.658 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 615' ' ' LEU . . . . . 0.597 HD13 HD11 ' B' ' 618' ' ' ILE . 4.5 mm? -62.63 -31.11 71.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.958 0.725 . . . . 1.8400000000000001 112.958 -177.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -79.54 2.14 23.3 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.662 1.356 . . . . 2.0600000000000001 114.662 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -142.42 15.61 2.02 Favored 'General case' 0 C--O 1.243 0.72 0 N-CA-C 113.152 0.797 . . . . 1.97 113.152 -174.254 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 618' ' ' ILE . . . . . 0.597 HD11 HD13 ' B' ' 615' ' ' LEU . 72.0 mt -46.83 -47.14 8.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 118.997 -1.081 . . . . 2.0099999999999998 110.176 -176.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 619' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -63.09 -51.14 67.79 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.744 1.016 . . . . 2.2799999999999998 113.744 -176.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 32.6 m -56.92 -31.87 65.38 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 119.487 -0.885 . . . . 1.3200000000000001 110.743 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 621' ' ' ILE . . . . . . . . . . . . . 64.6 mt -79.32 -42.7 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 115.334 1.605 . . . . 2.0 115.334 -178.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 622' ' ' ILE . . . . . 0.4 HG12 ' O ' ' B' ' 618' ' ' ILE . 47.2 pt -87.5 -6.48 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 115.059 1.503 . . . . 2.0899999999999999 115.059 -177.669 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 8.7 p -19.91 -58.3 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.575 2.065 . . . . 1.47 116.575 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -99.26 -7.57 26.23 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 114.045 -1.434 . . . . 2.0699999999999998 111.043 -163.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 625' ' ' LEU . . . . . . . . . . . . . 96.0 mt -71.93 146.9 47.51 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 123.286 0.366 . . . . 1.6699999999999999 111.601 -173.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 626' ' ' GLN . . . . . 0.438 ' O ' HG23 ' B' ' 630' ' ' VAL . 1.9 mp0 -76.74 162.09 71.7 Favored Pre-proline 0 CA--C 1.52 -0.191 0 N-CA-C 108.835 -0.802 . . . . 2.3500000000000001 108.835 174.686 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -47.85 -43.58 29.09 Favored 'Trans proline' 0 C--O 1.233 0.256 0 N-CA-C 115.765 1.409 . . . . 0.44 115.765 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -67.33 -42.98 82.67 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.637 -0.505 . . . . 2.6200000000000001 109.637 -174.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 629' ' ' GLN . . . . . 0.65 ' NE2' ' HA ' ' B' ' 582' ' ' ASP . 12.7 mm100 -63.31 -38.23 90.35 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.924 -0.58 . . . . 2.0600000000000001 110.924 178.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 630' ' ' VAL . . . . . 0.438 HG23 ' O ' ' B' ' 626' ' ' GLN . 95.1 t . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.315 -0.85 . . . . 1.3 110.685 176.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 44.7 pt . . . . . 0 C--O 1.237 0.419 0 N-CA-C 113.015 0.746 . . . . 2.1299999999999999 113.015 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 78.4 p -48.83 119.11 2.94 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.519 0.563 . . . . 1.29 112.519 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.76 1.53 67.92 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 120.961 -0.638 . . . . 0.0 114.436 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.39 -7.52 41.35 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 117.685 0.742 . . . . 0.02 112.434 176.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 67.5 mtt -112.45 159.97 18.22 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.116 0.484 . . . . 2.21 112.263 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 72.8 m80 -69.73 134.28 48.45 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.042 -0.725 . . . . 2.6699999999999999 109.042 174.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -41.73 -35.32 0.76 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.409 0.892 . . . . 2.6600000000000001 113.409 -173.255 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -73.88 -41.88 61.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.598 -0.728 . . . . 2.4399999999999999 112.097 -176.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -64.85 -40.18 94.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.184 0.516 . . . . 2.0800000000000001 110.823 171.244 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -53.61 -48.67 69.07 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.347 -0.842 . . . . 1.9199999999999999 111.199 177.36 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -54.91 -57.53 11.24 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 111.912 0.338 . . . . 2.73 111.912 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 515' ' ' ARG . . . . . 0.4 ' O ' HG23 ' B' ' 519' ' ' THR . 57.1 ttp180 -56.71 -35.92 69.07 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 124.16 0.913 . . . . 3.75 111.037 -177.478 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.515 ' O ' HG23 ' B' ' 520' ' ' VAL . 86.1 t80 -76.12 -45.52 33.33 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.191 -0.913 . . . . 1.8899999999999999 110.539 -173.365 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 517' ' ' LEU . . . . . 0.568 ' O ' HG22 ' B' ' 521' ' ' ILE . 0.2 OUTLIER -66.8 -32.2 73.33 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.738 -0.665 . . . . 1.8999999999999999 112.658 177.104 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 518' ' ' VAL . . . . . . . . . . . . . 3.2 p -67.49 -35.14 72.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 118.483 -1.287 . . . . 1.3999999999999999 109.031 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 519' ' ' THR . . . . . 0.4 HG23 ' O ' ' B' ' 515' ' ' ARG . 76.3 p -73.02 -36.3 66.94 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.348 0.594 . . . . 1.1799999999999999 112.401 178.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 520' ' ' VAL . . . . . 0.515 HG23 ' O ' ' B' ' 516' ' ' PHE . 55.5 t -71.25 -42.24 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 122.162 -0.336 . . . . 1.22 111.702 -174.452 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 521' ' ' ILE . . . . . 0.568 HG22 ' O ' ' B' ' 517' ' ' LEU . 13.5 tt -90.73 -25.83 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 115.42 1.637 . . . . 1.98 115.42 -175.155 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -60.77 -35.19 75.81 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.712 -0.847 . . . . 2.5699999999999998 108.712 173.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 523' ' ' ASP . . . . . 0.419 ' O ' HD23 ' B' ' 527' ' ' LEU . 22.0 m-20 -92.5 -21.44 20.14 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 115.001 1.482 . . . . 2.1699999999999999 115.001 -177.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 70.1 mt -70.69 -45.27 65.33 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.314 -0.624 . . . . 1.48 109.314 168.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 70.1 mt -52.32 -45.42 65.59 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.315 0.579 . . . . 1.95 110.962 169.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.47 -40.53 94.38 Favored Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 527' ' ' LEU . . . . . 0.419 HD23 ' O ' ' B' ' 523' ' ' ASP . 2.6 mm? -63.63 -36.14 82.83 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.036 0.446 . . . . 1.6699999999999999 111.426 175.725 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 40.2 t -63.54 -47.68 80.61 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.023 -0.535 . . . . 0.58999999999999997 110.699 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.67 -29.6 70.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.485 -0.78 . . . . 2.5 112.566 173.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -71.78 -54.68 9.42 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.283 0.846 . . . . 2.2400000000000002 113.283 -177.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 531' ' ' LYS . . . . . 0.563 ' HD2' HD11 ' B' ' 540' ' ' ILE . 80.0 mttt -68.73 137.89 54.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.065 -0.516 . . . . 2.2799999999999998 111.047 -177.459 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -96.42 160.63 14.31 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.837 -0.619 . . . . 4.21 110.158 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.47 119.58 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.848 -0.614 . . . . 0.0 114.022 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -47.02 -36.66 8.14 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.259 0.837 . . . . 2.9500000000000002 113.259 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -50.56 -51.85 44.32 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.373 -0.531 . . . . 2.2000000000000002 110.809 174.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.06 -44.83 83.37 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.62 0.6 . . . . 1.47 112.62 178.314 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 537' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -67.87 -31.9 72.03 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.272 -174.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 538' ' ' ALA . . . . . 0.407 ' HB2' ' CD2' ' B' ' 577' ' ' HIS . . . -68.21 -47.0 69.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.862 -0.608 . . . . 0.040000000000000001 111.048 178.5 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 48.4 mm -58.12 -54.98 25.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 121.549 0.69 . . . . 1.8200000000000001 111.234 173.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 540' ' ' ILE . . . . . 0.563 HD11 ' HD2' ' B' ' 531' ' ' LYS . 80.7 mt -56.75 -48.14 81.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.59 -178.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.46 -44.09 84.52 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 113.595 0.961 . . . . 0.02 113.595 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 62.3 m -60.42 -38.81 85.23 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 120.545 -0.462 . . . . 1.2 110.306 -178.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 40.5 t-20 -68.92 -47.12 66.54 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 114.365 1.246 . . . . 2.0299999999999998 114.365 -175.309 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 544' ' ' ILE . . . . . 0.411 HG23 HG13 ' B' ' 521' ' ' ILE . 95.1 mt -52.6 -46.06 48.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.424 -0.954 . . . . 1.8100000000000001 108.424 170.074 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 545' ' ' MET . . . . . 0.754 ' HB3' HG21 ' B' ' 587' ' ' THR . 45.3 mtp -63.97 -42.33 97.28 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.78 -0.768 . . . . 2.6000000000000001 112.818 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -58.35 -48.71 79.7 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 119.145 -1.022 . . . . 2.0800000000000001 109.932 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 80.8 mt -55.07 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.8 0.667 . . . . 1.5 112.8 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 548' ' ' VAL . . . . . 0.441 HG22 ' HA ' ' B' ' 545' ' ' MET . 33.8 m -47.42 -44.17 9.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.812 -0.755 . . . . 1.3999999999999999 111.427 176.265 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 549' ' ' GLY . . . . . 0.496 ' HA2' HD11 ' B' ' 591' ' ' ILE . . . -57.41 -28.08 58.9 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -86.99 -9.57 55.26 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.614 0.598 . . . . 2.27 112.614 -175.329 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -120.43 59.74 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.781 1.03 . . . . 3.5299999999999998 113.781 -176.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.03 -39.36 91.69 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 O-C-N 122.071 0.511 . . . . 0.46000000000000002 113.134 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 9.9 mmm180 -56.23 -46.78 79.4 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 121.169 0.509 . . . . 3.8700000000000001 109.974 -174.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -48.9 -59.84 3.25 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 123.89 0.876 . . . . 0.69999999999999996 112.101 167.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 555' ' ' LEU . . . . . . . . . . . . . 11.2 mp -54.26 -48.56 71.05 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 116.267 -0.424 . . . . 1.49 110.202 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 556' ' ' ARG . . . . . 0.484 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 78.6 ttt180 -53.93 -35.87 62.16 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 113.827 1.047 . . . . 3.0899999999999999 113.827 -178.278 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.06 -12.17 50.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.517 -0.473 . . . . 0.0 112.102 -177.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -128.23 78.5 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 2.9300000000000002 114.388 -177.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 33.4 p90 -50.51 -48.28 57.06 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 116.57 2.063 . . . . 3.1099999999999999 116.57 -176.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -56.57 -36.68 69.62 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.23 -0.441 . . . . 3.3199999999999998 111.136 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 561' ' ' PHE . . . . . 0.489 ' O ' HG23 ' B' ' 565' ' ' VAL . 3.5 t80 -74.89 -45.08 45.24 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.092 -1.043 . . . . 1.25 111.978 175.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 562' ' ' LEU . . . . . 0.419 ' O ' HG23 ' B' ' 566' ' ' VAL . 2.9 tt -49.99 -59.13 4.18 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 122.403 0.281 . . . . 1.3200000000000001 110.34 175.004 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.14 -38.63 40.18 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.922 1.082 . . . . 2.7400000000000002 113.922 178.802 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 20.1 p -71.89 -39.31 69.66 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.732 -0.667 . . . . 1.24 110.356 -176.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 565' ' ' VAL . . . . . 0.489 HG23 ' O ' ' B' ' 561' ' ' PHE . 68.5 t -62.81 -41.31 92.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.685 -0.689 . . . . 1.1899999999999999 112.542 173.358 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 566' ' ' VAL . . . . . 0.562 HG21 ' HZ ' ' B' ' 599' ' ' PHE . 58.1 t -71.0 -50.93 39.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.542 -0.463 . . . . 1.3600000000000001 110.844 -176.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -51.08 -37.37 45.32 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.996 -0.547 . . . . 1.9399999999999999 112.012 170.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 29.2 ttpt -72.67 -32.6 65.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.753 -0.462 . . . . 3.5299999999999998 109.753 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 569' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' B' ' 573' ' ' MET . 4.2 mp -67.46 -36.5 81.28 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.73 -0.841 . . . . 2.0099999999999998 108.73 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 570' ' ' PHE . . . . . 0.516 ' HD1' HG13 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.38 -39.38 92.17 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.872 -0.418 . . . . 3.77 109.872 178.372 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -57.66 -53.45 58.06 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 119.999 -0.68 . . . . 2.4700000000000002 110.545 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.56 -9.86 10.16 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.079 1.14 . . . . 1.23 114.079 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 573' ' ' MET . . . . . 0.924 ' HB3' HD11 ' B' ' 625' ' ' LEU . 64.0 mtt -76.42 -5.35 46.93 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.639 0.733 . . . . 2.1099999999999999 109.662 178.612 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -109.4 -0.48 18.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.755 -1.112 . . . . 3.2000000000000002 111.428 173.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 575' ' ' GLU . . . . . 0.445 ' HG2' HG11 ' B' ' 580' ' ' VAL . 14.4 tp10 -68.48 130.2 42.17 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.214 -0.448 . . . . 1.55 110.079 177.539 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 7.2 m -87.87 -21.24 25.1 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.042 0.756 . . . . 1.3999999999999999 113.042 -177.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 577' ' ' HIS . . . . . 0.576 ' HD1' ' H ' ' B' ' 578' ' ' ASP . 0.8 OUTLIER -60.22 128.03 34.75 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.411 0.624 . . . . 2.8500000000000001 112.596 -175.4 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 578' ' ' ASP . . . . . 0.576 ' H ' ' HD1' ' B' ' 577' ' ' HIS . 7.1 m-20 -44.88 125.88 5.38 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.388 -0.824 . . . . 2.1499999999999999 113.063 -171.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.26 -34.75 4.75 Favored Glycine 0 C--O 1.222 -0.627 0 N-CA-C 116.29 1.276 . . . . 0.0 116.29 174.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 580' ' ' VAL . . . . . 0.445 HG11 ' HG2' ' B' ' 575' ' ' GLU . 58.1 t -53.68 -46.42 61.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.146 0.795 . . . . 1.29 113.146 -175.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -59.6 -42.31 92.29 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.383 0.512 . . . . 1.99 112.383 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -60.54 -42.42 96.46 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.213 0.449 . . . . 2.23 112.213 172.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 25.7 mmt -60.71 -49.48 77.32 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.058 -0.257 . . . . 2.5800000000000001 110.447 175.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.86 -42.83 80.46 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.159 -0.473 . . . . 0.029999999999999999 111.79 -177.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 585' ' ' CYS . . . . . 0.464 ' SG ' ' HG3' ' B' ' 629' ' ' GLN . 23.6 p -74.4 -40.92 61.73 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 119.957 -0.697 . . . . 1.5 111.984 -177.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 586' ' ' ASP . . . . . 0.489 ' O ' HG12 ' B' ' 589' ' ' ILE . 18.0 t70 -59.53 -46.38 89.04 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.273 -0.421 . . . . 1.98 111.92 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 587' ' ' THR . . . . . 0.754 HG21 ' HB3' ' B' ' 545' ' ' MET . 40.4 p -62.19 -41.18 98.1 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.3 110.43 175.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -61.55 -32.14 72.2 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.035 -0.53 . . . . 0.53000000000000003 111.153 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 589' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 586' ' ' ASP . 41.5 pt -79.94 -35.85 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.871 -1.932 . . . . 1.97 109.76 -175.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -57.52 -50.04 74.38 Favored 'General case' 0 C--O 1.221 -0.438 0 N-CA-C 107.701 -1.222 . . . . 2.6200000000000001 107.701 176.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 591' ' ' ILE . . . . . 0.496 HD11 ' HA2' ' B' ' 549' ' ' GLY . 1.7 mp -63.77 -43.74 98.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.689 -0.687 . . . . 1.96 112.815 -176.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.04 93.23 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.392 -0.523 . . . . 0.0 112.301 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -62.4 -70.06 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 119.112 -1.035 . . . . 2.3599999999999999 109.793 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -56.09 -23.84 36.41 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 116.608 2.077 . . . . 2.1899999999999999 116.608 -176.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.1 p -121.68 25.25 9.38 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 114.201 1.186 . . . . 1.26 114.201 -178.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -48.46 -38.6 20.37 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 115.825 1.787 . . . . 3.5800000000000001 115.825 -172.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 597' ' ' ARG . . . . . 0.421 ' O ' HG12 ' B' ' 600' ' ' VAL . 54.8 mtp180 -69.54 -32.63 71.55 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.201 0.815 . . . . 3.7400000000000002 113.201 -175.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 598' ' ' HIS . . . . . 0.484 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 61.9 m-70 -70.2 -3.77 18.51 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.603 -0.726 . . . . 2.1400000000000001 112.05 -173.549 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 599' ' ' PHE . . . . . 0.562 ' HZ ' HG21 ' B' ' 566' ' ' VAL . 3.2 m-85 -105.52 -16.95 14.57 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 123.597 0.561 . . . . 2.9500000000000002 110.257 -176.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 600' ' ' VAL . . . . . 0.421 HG12 ' O ' ' B' ' 597' ' ' ARG . 15.0 p -105.76 -24.38 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.091 -0.959 . . . . 1.4199999999999999 111.319 -175.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -102.03 139.51 37.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.578 -0.849 . . . . 2.3399999999999999 111.55 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 16.1 m -60.89 122.71 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.611 -0.885 . . . . 1.3700000000000001 108.611 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -92.78 167.29 11.96 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 123.648 0.592 . . . . 2.6800000000000002 110.06 -177.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 42.9 t -71.93 128.93 35.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 N-CA-C 112.971 0.73 . . . . 1.27 112.971 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.38 6.53 64.38 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.062 -175.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 606' ' ' GLU . . . . . 0.509 ' HG2' ' H ' ' B' ' 608' ' ' MET . 34.7 tt0 -131.49 158.01 42.03 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.626 -0.83 . . . . 2.5099999999999998 110.756 175.598 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 19.1 t -103.28 -22.55 4.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.055 -0.975 . . . . 1.3999999999999999 112.451 -175.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 608' ' ' MET . . . . . 0.509 ' H ' ' HG2' ' B' ' 606' ' ' GLU . 96.4 mmm -136.96 142.21 37.67 Favored Pre-proline 0 C--O 1.222 -0.343 0 N-CA-C 112.615 0.598 . . . . 2.6800000000000002 112.615 -174.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 609' ' ' PRO . . . . . 0.55 ' HB2' HG22 ' B' ' 611' ' ' ILE . 10.3 Cg_endo -52.13 130.85 36.91 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 120.83 1.02 . . . . 0.42999999999999999 112.162 179.224 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -56.9 -31.85 65.3 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.866 0.321 . . . . 2.3700000000000001 111.866 -174.15 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 611' ' ' ILE . . . . . 0.55 HG22 ' HB2' ' B' ' 609' ' ' PRO . 6.7 tp -50.0 -44.88 22.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 CA-C-O 120.787 0.327 . . . . 1.8400000000000001 110.555 178.202 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 612' ' ' ASP . . . . . 0.448 ' OD1' ' HG2' ' B' ' 609' ' ' PRO . 0.9 OUTLIER -49.86 -52.0 36.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.612 0.765 . . . . 2.1499999999999999 112.875 177.698 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -59.95 -37.13 78.67 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.606 -0.438 . . . . 2.6600000000000001 110.175 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 62.7 mt -64.55 -47.96 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.117 -0.633 . . . . 1.76 111.968 178.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 615' ' ' LEU . . . . . 0.469 HD12 HD11 ' B' ' 618' ' ' ILE . 57.2 tp -62.6 -31.13 71.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.955 0.724 . . . . 1.8400000000000001 112.955 -177.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -79.57 2.11 23.46 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.599 1.333 . . . . 2.0600000000000001 114.599 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 617' ' ' ASN . . . . . 0.528 ' HB3' HG22 ' B' ' 620' ' ' THR . 91.0 m-20 -142.48 15.79 2.01 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 113.104 0.779 . . . . 1.97 113.104 -174.259 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 618' ' ' ILE . . . . . 0.469 HD11 HD12 ' B' ' 615' ' ' LEU . 81.0 mt -46.93 -47.06 8.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 C-N-CA 118.929 -1.109 . . . . 2.0099999999999998 110.177 -176.75 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 619' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -63.19 -51.1 67.7 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.703 1.001 . . . . 2.2799999999999998 113.703 -176.326 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 620' ' ' THR . . . . . 0.528 HG22 ' HB3' ' B' ' 617' ' ' ASN . 8.8 t -56.94 -31.82 65.35 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.46 -0.896 . . . . 1.3200000000000001 110.741 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 621' ' ' ILE . . . . . 0.516 HG13 ' HD1' ' B' ' 570' ' ' PHE . 15.7 tt -79.36 -42.67 23.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 115.267 1.58 . . . . 2.0 115.267 -178.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 622' ' ' ILE . . . . . 0.829 ' HA ' HD13 ' B' ' 625' ' ' LEU . 0.2 OUTLIER -87.7 -6.27 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.011 1.485 . . . . 2.0899999999999999 115.011 -177.586 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.7 t -20.05 -58.28 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 116.538 2.051 . . . . 1.47 116.538 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -99.33 -7.53 26.16 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.061 -1.427 . . . . 2.0699999999999998 111.007 -163.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 625' ' ' LEU . . . . . 0.924 HD11 ' HB3' ' B' ' 573' ' ' MET . 9.0 mp -71.87 146.85 47.64 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 123.326 0.391 . . . . 1.6699999999999999 111.769 -173.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 626' ' ' GLN . . . . . 0.504 ' O ' HG23 ' B' ' 630' ' ' VAL . 11.8 pt20 -76.69 162.08 71.8 Favored Pre-proline 0 CA--C 1.519 -0.22 0 N-CA-C 108.843 -0.799 . . . . 2.3500000000000001 108.843 174.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 627' ' ' PRO . . . . . 0.405 ' HD2' ' HB2' ' B' ' 626' ' ' GLN . 85.2 Cg_exo -47.86 -43.63 29.0 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.792 1.42 . . . . 0.44 115.792 -178.432 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -67.29 -43.07 82.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.573 -0.528 . . . . 2.6200000000000001 109.573 -174.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 629' ' ' GLN . . . . . 0.464 ' HG3' ' SG ' ' B' ' 585' ' ' CYS . 1.1 mp0 -63.18 -38.37 90.89 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.934 -0.575 . . . . 2.0600000000000001 110.928 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 630' ' ' VAL . . . . . 0.517 HG22 HG12 ' B' ' 622' ' ' ILE . 59.8 t . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.207 -0.901 . . . . 1.3 110.687 176.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 112.525 -0.23 . . . . 9.8599999999999994 112.525 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 78.0 p -85.6 -56.36 3.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.742 0.306 . . . . 8.7799999999999994 110.978 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 58.52 88.03 0.07 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.207 -0.451 . . . . 6.8200000000000003 111.377 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.7 t -74.85 -68.3 0.56 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 6.25 110.737 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -178.83 154.02 13.53 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.84 -0.695 . . . . 4.1200000000000001 112.623 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -167.26 -38.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.905 0.383 . . . . 4.0300000000000002 110.584 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.598 HD13 HD22 ' A' ' 10' ' ' LEU . 3.9 mm? -61.58 -15.59 40.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.948 -0.569 . . . . 2.21 111.25 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -64.78 -35.35 80.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 3.79 111.311 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -78.78 -23.71 45.08 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.415 -0.357 . . . . 4.1699999999999999 110.727 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.598 HD22 HD13 ' A' ' 7' ' ' LEU . 9.6 mp -76.75 -13.37 60.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.144 -0.48 . . . . 2.5800000000000001 110.727 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.02 -42.17 24.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.027 -0.533 . . . . 2.8399999999999999 111.344 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.9 tp -59.61 -22.89 62.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.249 -0.432 . . . . 3.6699999999999999 111.249 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.456 ' O ' HD21 ' B' ' 525' ' ' LEU . 75.0 mmtt -71.11 -48.25 53.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.381 -0.372 . . . . 4.9299999999999997 110.901 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.516 HD12 HD13 ' B' ' 525' ' ' LEU . 56.4 tp -57.44 -19.97 27.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.451 . . . . 3.27 111.154 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.81 -15.36 20.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.267 -0.424 . . . . 3.1299999999999999 111.278 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -103.78 79.33 0.31 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.93 -0.652 . . . . 2.4700000000000002 112.535 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.466 HD22 ' HZ ' ' B' ' 572' ' ' PHE . 5.2 tt -142.98 90.43 2.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.75 0.31 . . . . 2.1400000000000001 110.492 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -85.76 162.53 18.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 3.9199999999999999 110.847 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 13.9 tt -166.41 -37.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.506 . . . . 3.25 110.954 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.401 ' O ' ' N ' ' A' ' 22' ' ' THR . 27.2 t-20 -150.15 -88.68 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 5.9500000000000002 110.756 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.4 ttmp? 53.8 -87.7 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.467 -0.333 . . . . 9.3900000000000006 111.143 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.401 ' N ' ' O ' ' A' ' 20' ' ' ASN . 88.8 m -128.0 -75.55 0.57 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.426 -0.352 . . . . 8.9700000000000006 111.055 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 59.19 83.72 0.12 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.091 -0.504 . . . . 11.67 111.042 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -104.35 39.18 2.92 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.878 -0.677 . . . . 12.859999999999999 112.756 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -113.68 145.52 41.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.696 0.284 . . . . 15.369999999999999 110.804 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.75 -177.58 5.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.326 -0.397 . . . . 16.539999999999999 111.052 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 76.7 m . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.316 -0.85 . . . . 17.93 110.867 -179.987 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 39.5 pt . . . . . 0 C--O 1.236 0.342 0 N-CA-C 113.024 0.75 . . . . 2.1299999999999999 113.024 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 80.5 p -48.89 119.18 3.01 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.576 0.584 . . . . 1.29 112.576 174.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.82 1.43 67.84 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 120.913 -0.66 . . . . 0.0 114.476 -179.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.33 -7.63 41.25 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 117.659 0.73 . . . . 0.02 112.431 176.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 86.4 mtp -112.41 159.96 18.2 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.29 0.478 . . . . 2.21 112.29 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -69.67 134.24 48.46 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 109.146 -0.687 . . . . 2.6699999999999999 109.146 174.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -41.71 -35.42 0.78 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.37 0.878 . . . . 2.6600000000000001 113.37 -173.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -73.84 -41.89 61.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.584 -0.734 . . . . 2.4399999999999999 112.07 -176.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -64.83 -40.11 94.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.158 0.504 . . . . 2.0800000000000001 110.88 171.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -53.72 -48.58 69.46 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.303 -0.862 . . . . 1.9199999999999999 111.205 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -54.85 -57.6 10.94 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 111.9 0.333 . . . . 2.73 111.9 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 515' ' ' ARG . . . . . 0.479 ' O ' HG12 ' B' ' 518' ' ' VAL . 81.2 mtp180 -56.63 -35.93 68.9 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.157 0.911 . . . . 3.75 111.086 -177.511 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.699 ' O ' HG13 ' B' ' 520' ' ' VAL . 76.5 t80 -76.14 -45.56 33.01 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.104 -0.953 . . . . 1.8899999999999999 110.504 -173.337 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 517' ' ' LEU . . . . . 0.759 ' HA ' HG22 ' B' ' 520' ' ' VAL . 8.5 tp -66.76 -32.23 73.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.731 -0.668 . . . . 1.8999999999999999 112.591 177.186 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 518' ' ' VAL . . . . . 0.479 HG12 ' O ' ' B' ' 515' ' ' ARG . 7.7 p -67.57 -35.07 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 118.483 -1.287 . . . . 1.3999999999999999 109.021 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 42.8 m -72.9 -36.38 67.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.41 0.624 . . . . 1.1799999999999999 112.444 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 520' ' ' VAL . . . . . 0.786 HG23 HG13 ' B' ' 521' ' ' ILE . 25.5 m -71.21 -42.3 75.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.395 -0.366 . . . . 1.22 111.636 -174.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 521' ' ' ILE . . . . . 0.786 HG13 HG23 ' B' ' 520' ' ' VAL . 82.4 mt -90.69 -25.86 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 N-CA-C 115.418 1.636 . . . . 1.98 115.418 -175.097 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -60.82 -35.16 75.81 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.717 -0.845 . . . . 2.5699999999999998 108.717 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -92.4 -21.62 20.11 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.032 1.493 . . . . 2.1699999999999999 115.032 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 524' ' ' LEU . . . . . 0.635 HD23 ' HB ' ' B' ' 544' ' ' ILE . 16.4 tp -70.53 -45.45 65.51 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 109.325 -0.621 . . . . 1.48 109.325 168.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 525' ' ' LEU . . . . . 0.516 HD13 HD12 ' A' ' 14' ' ' LEU . 43.2 tp -52.15 -45.52 65.06 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-O 121.211 0.529 . . . . 1.95 110.953 169.69 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.46 -40.57 94.42 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 527' ' ' LEU . . . . . 0.401 HD23 HD12 ' B' ' 540' ' ' ILE . 52.2 tp -63.53 -36.16 82.87 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.057 0.456 . . . . 1.6699999999999999 111.483 175.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 49.9 t -63.47 -47.74 80.58 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.012 -0.54 . . . . 0.58999999999999997 110.705 -175.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -61.68 -29.65 70.22 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.508 -0.769 . . . . 2.5 112.56 173.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -71.65 -54.71 9.49 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.369 0.877 . . . . 2.2400000000000002 113.369 -177.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -68.76 137.99 54.49 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.98 -0.555 . . . . 2.2799999999999998 111.031 -177.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -96.49 160.72 14.25 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.749 -0.66 . . . . 4.21 110.19 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.64 1.35 Allowed Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.912 -0.585 . . . . 0.0 114.031 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -47.18 -36.61 8.89 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 113.175 0.805 . . . . 2.9500000000000002 113.175 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -50.53 -51.86 43.88 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.376 -0.53 . . . . 2.2000000000000002 110.823 174.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -66.05 -44.85 83.37 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.62 0.6 . . . . 1.47 112.62 178.344 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 537' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -67.87 -31.95 72.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.272 -174.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.12 -46.96 69.45 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 115.815 -0.629 . . . . 0.040000000000000001 111.149 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 74.4 mt -58.24 -54.9 26.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 1.8200000000000001 111.218 173.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 540' ' ' ILE . . . . . 0.401 HD12 HD23 ' B' ' 527' ' ' LEU . 47.0 mm -56.73 -48.17 81.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.601 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 541' ' ' ALA . . . . . 0.412 ' O ' ' CG2' ' B' ' 544' ' ' ILE . . . -57.48 -43.98 84.54 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 113.599 0.963 . . . . 0.02 113.599 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 542' ' ' SER . . . . . 0.56 ' HA ' ' HE3' ' B' ' 545' ' ' MET . 92.5 p -60.54 -38.7 85.31 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.557 -0.457 . . . . 1.2 110.301 -178.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -69.1 -47.07 66.14 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 114.298 1.221 . . . . 2.0299999999999998 114.298 -175.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 544' ' ' ILE . . . . . 0.635 ' HB ' HD23 ' B' ' 524' ' ' LEU . 7.8 tt -52.6 -45.92 48.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 108.52 -0.919 . . . . 1.8100000000000001 108.52 170.07 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 545' ' ' MET . . . . . 0.56 ' HE3' ' HA ' ' B' ' 542' ' ' SER . 74.5 mtm -64.03 -42.33 97.13 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.744 -0.782 . . . . 2.6000000000000001 112.766 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -58.39 -48.73 79.68 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 119.224 -0.991 . . . . 2.0800000000000001 109.838 176.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 36.1 mm -55.05 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.794 0.664 . . . . 1.5 112.794 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 548' ' ' VAL . . . . . 0.621 HG22 HD11 ' B' ' 555' ' ' LEU . 9.3 p -47.36 -44.21 8.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 C-N-CA 119.77 -0.772 . . . . 1.3999999999999999 111.488 176.245 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.05 58.85 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.845 -0.534 . . . . 0.0 112.908 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 550' ' ' GLN . . . . . 0.459 ' C ' ' HD3' ' B' ' 552' ' ' PRO . 16.1 mm100 -87.06 -9.56 55.14 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.617 0.599 . . . . 2.27 112.617 -175.331 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -120.39 59.67 7.01 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.807 1.04 . . . . 3.5299999999999998 113.807 -177.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 552' ' ' PRO . . . . . 0.459 ' HD3' ' C ' ' B' ' 550' ' ' GLN . 34.4 Cg_exo -55.98 -39.34 91.81 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.068 0.509 . . . . 0.46000000000000002 113.152 177.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -56.3 -46.65 79.72 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 121.164 0.507 . . . . 3.8700000000000001 109.997 -174.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -49.02 -59.64 3.45 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 123.931 0.892 . . . . 0.69999999999999996 112.158 167.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 555' ' ' LEU . . . . . 0.621 HD11 HG22 ' B' ' 548' ' ' VAL . 82.2 mt -54.41 -48.51 71.53 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 116.271 -0.422 . . . . 1.49 110.195 -179.003 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 556' ' ' ARG . . . . . 0.547 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 56.0 ttt180 -53.98 -35.82 62.24 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.833 1.049 . . . . 3.0899999999999999 113.833 -178.276 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.05 -12.18 50.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.538 -0.465 . . . . 0.0 112.106 -177.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 558' ' ' HIS . . . . . 0.418 ' CG ' ' HG ' ' A' ' 7' ' ' LEU . 51.0 m-70 -128.21 78.51 1.84 Allowed 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.393 1.257 . . . . 2.9300000000000002 114.393 -177.565 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 5.6 m-90 -50.63 -48.22 58.15 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.492 2.034 . . . . 3.1099999999999999 116.492 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -56.68 -36.56 69.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.423 . . . . 3.3199999999999998 111.152 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 561' ' ' PHE . . . . . 0.516 ' O ' HG23 ' B' ' 565' ' ' VAL . 1.4 t80 -74.92 -45.12 44.7 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.126 -1.03 . . . . 1.25 111.882 175.588 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 562' ' ' LEU . . . . . 0.638 HD12 HD11 ' B' ' 591' ' ' ILE . 26.2 tp -50.01 -59.09 4.22 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 122.44 0.296 . . . . 1.3200000000000001 110.314 175.095 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -50.24 -38.63 41.57 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.864 1.061 . . . . 2.7400000000000002 113.864 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 564' ' ' THR . . . . . 0.471 HG22 HD23 ' A' ' 14' ' ' LEU . 89.9 m -71.73 -39.42 70.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.583 0.706 . . . . 1.24 110.413 -176.119 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 565' ' ' VAL . . . . . 0.516 HG23 ' O ' ' B' ' 561' ' ' PHE . 59.3 t -62.81 -41.34 92.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 115.667 -0.697 . . . . 1.1899999999999999 112.529 173.394 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 566' ' ' VAL . . . . . 0.479 HG23 ' O ' ' B' ' 562' ' ' LEU . 42.3 t -70.94 -50.82 40.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.49 -0.484 . . . . 1.3600000000000001 110.873 -176.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -51.1 -37.48 46.12 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.075 -0.512 . . . . 1.9399999999999999 111.978 170.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 568' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' B' ' 568' ' ' LYS . 25.5 mmtp -72.55 -32.73 66.31 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.723 -0.473 . . . . 3.5299999999999998 109.723 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 569' ' ' LEU . . . . . 0.429 ' O ' ' HG3' ' B' ' 573' ' ' MET . 57.1 mt -67.52 -36.43 81.02 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 108.66 -0.867 . . . . 2.0099999999999998 108.66 177.123 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 570' ' ' PHE . . . . . 0.426 ' CE2' HG12 ' B' ' 566' ' ' VAL . 16.2 m-85 -65.4 -39.38 92.11 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.859 -0.423 . . . . 3.77 109.859 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -57.69 -53.53 57.13 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.881 -0.727 . . . . 2.4700000000000002 110.483 176.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 572' ' ' PHE . . . . . 0.466 ' HZ ' HD22 ' A' ' 17' ' ' LEU . 54.0 m-85 -62.39 -9.89 9.7 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.158 1.17 . . . . 1.23 114.158 -177.206 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 573' ' ' MET . . . . . 0.82 ' HB3' HD11 ' B' ' 625' ' ' LEU . 26.5 mtm -76.42 -5.29 46.69 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.671 0.748 . . . . 2.1099999999999999 109.667 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -109.49 -0.59 18.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.765 -1.107 . . . . 3.2000000000000002 111.395 173.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 575' ' ' GLU . . . . . 0.462 ' HG2' HG11 ' B' ' 580' ' ' VAL . 18.6 tp10 -68.46 130.26 42.36 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.233 -0.44 . . . . 1.55 110.188 177.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 10.2 t -87.88 -21.34 25.04 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 112.947 0.721 . . . . 1.3999999999999999 112.947 -177.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -60.17 128.01 34.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.48 0.657 . . . . 2.8500000000000001 112.516 -175.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -44.81 125.83 5.28 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.391 -0.822 . . . . 2.1499999999999999 113.095 -171.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.62 4.83 Favored Glycine 0 C--O 1.223 -0.57 0 N-CA-C 116.294 1.278 . . . . 0.0 116.294 174.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 580' ' ' VAL . . . . . 0.462 HG11 ' HG2' ' B' ' 575' ' ' GLU . 43.1 t -53.88 -46.35 63.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 113.057 0.762 . . . . 1.29 113.057 -175.477 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.64 -42.25 92.34 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.409 0.522 . . . . 1.99 112.409 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -60.54 -42.45 96.54 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.159 0.429 . . . . 2.23 112.159 172.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 583' ' ' MET . . . . . 0.454 ' HG2' ' HA ' ' B' ' 542' ' ' SER . 3.1 tpt -60.7 -49.53 77.15 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 121.058 -0.257 . . . . 2.5800000000000001 110.416 175.543 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.89 80.29 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.181 -0.463 . . . . 0.029999999999999999 111.744 -177.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 81.2 m -74.44 -40.92 61.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 119.976 -0.69 . . . . 1.5 111.938 -177.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 586' ' ' ASP . . . . . 0.639 ' O ' HG22 ' B' ' 589' ' ' ILE . 2.0 m-20 -59.6 -46.32 89.3 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.273 -0.421 . . . . 1.98 111.974 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 87.2 m -62.16 -41.22 98.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.3 110.43 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 588' ' ' PHE . . . . . 0.587 ' O ' HG22 ' B' ' 591' ' ' ILE . 87.8 t80 -61.4 -32.22 72.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.047 -0.524 . . . . 0.53000000000000003 111.232 -177.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 589' ' ' ILE . . . . . 0.639 HG22 ' O ' ' B' ' 586' ' ' ASP . 9.7 tp -79.91 -35.99 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.871 -1.932 . . . . 1.97 109.74 -175.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -57.41 -50.04 74.3 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 107.752 -1.203 . . . . 2.6200000000000001 107.752 176.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 591' ' ' ILE . . . . . 0.638 HD11 HD12 ' B' ' 562' ' ' LEU . 12.2 tt -63.75 -43.72 98.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 112.885 0.698 . . . . 1.96 112.885 -177.062 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.94 -39.12 93.42 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.407 -0.517 . . . . 0.0 112.275 177.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -62.32 -70.08 0.22 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 119.113 -1.035 . . . . 2.3599999999999999 109.848 174.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 594' ' ' LYS . . . . . 0.478 ' HD2' ' N ' ' B' ' 594' ' ' LYS . 13.5 mptt -56.15 -23.76 36.82 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 116.56 2.059 . . . . 2.1899999999999999 116.56 -176.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.1 p -121.76 25.29 9.31 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.222 1.193 . . . . 1.26 114.222 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -48.61 -38.45 20.92 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.838 1.792 . . . . 3.5800000000000001 115.838 -172.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 597' ' ' ARG . . . . . 0.407 ' O ' HG22 ' B' ' 600' ' ' VAL . 38.7 mmt180 -69.56 -32.61 71.5 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.202 0.816 . . . . 3.7400000000000002 113.202 -175.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 598' ' ' HIS . . . . . 0.547 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 89.4 m-70 -70.21 -3.81 18.68 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.588 -0.733 . . . . 2.1400000000000001 112.052 -173.552 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 599' ' ' PHE . . . . . 0.518 ' O ' HG23 ' B' ' 611' ' ' ILE . 8.7 m-85 -105.64 -16.81 14.59 Favored 'General case' 0 CA--C 1.517 -0.301 0 O-C-N 123.621 0.576 . . . . 2.9500000000000002 110.204 -176.552 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 600' ' ' VAL . . . . . 0.455 HG12 HD13 ' B' ' 611' ' ' ILE . 34.5 m -105.85 -24.37 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 115.084 -0.962 . . . . 1.4199999999999999 111.355 -175.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -102.0 139.46 37.6 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 119.504 -0.879 . . . . 2.3399999999999999 111.661 176.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 4.8 p -60.86 122.81 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 N-CA-C 108.639 -0.874 . . . . 1.3700000000000001 108.639 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -92.88 167.33 11.91 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 123.645 0.591 . . . . 2.6800000000000002 110.049 -177.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 30.8 t -71.91 128.81 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 113.022 0.749 . . . . 1.27 113.022 -175.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.46 6.57 64.2 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.062 -175.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 606' ' ' GLU . . . . . 0.569 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.0 tp10 -131.45 158.08 41.79 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.626 -0.83 . . . . 2.5099999999999998 110.772 175.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 40.3 t -103.34 -22.57 4.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.04 -0.982 . . . . 1.3999999999999999 112.527 -175.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 608' ' ' MET . . . . . 0.569 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 22.7 ptp -136.92 142.25 37.88 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.611 0.597 . . . . 2.6800000000000002 112.611 -174.255 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.11 130.9 37.05 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.889 1.06 . . . . 0.42999999999999999 112.085 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 610' ' ' PHE . . . . . 0.434 ' CE2' HD11 ' B' ' 614' ' ' ILE . 16.4 t80 -57.04 -31.8 65.54 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.794 0.294 . . . . 2.3700000000000001 111.794 -174.141 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 611' ' ' ILE . . . . . 0.518 HG23 ' O ' ' B' ' 599' ' ' PHE . 8.9 pt -50.14 -44.71 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 120.811 0.339 . . . . 1.8400000000000001 110.591 178.244 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -49.93 -52.05 36.32 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.666 0.786 . . . . 2.1499999999999999 112.844 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 613' ' ' GLU . . . . . 0.475 ' O ' ' ND2' ' B' ' 617' ' ' ASN . 42.8 mt-10 -59.91 -37.09 78.45 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.562 -0.455 . . . . 2.6600000000000001 110.241 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 614' ' ' ILE . . . . . 0.434 HD11 ' CE2' ' B' ' 610' ' ' PHE . 24.5 mm -64.51 -47.97 86.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.934 0 C-N-CA 120.118 -0.633 . . . . 1.76 112.013 178.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 9.9 tt -62.69 -31.08 71.92 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.978 0.733 . . . . 1.8400000000000001 112.978 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -79.54 2.12 23.36 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.621 1.341 . . . . 2.0600000000000001 114.621 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 617' ' ' ASN . . . . . 0.475 ' ND2' ' O ' ' B' ' 613' ' ' GLU . 29.7 p30 -142.44 15.68 2.02 Favored 'General case' 0 C--O 1.242 0.685 0 N-CA-C 113.138 0.792 . . . . 1.97 113.138 -174.235 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 618' ' ' ILE . . . . . 0.494 ' O ' HG12 ' B' ' 621' ' ' ILE . 10.5 tt -46.97 -46.99 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 C-N-CA 118.921 -1.112 . . . . 2.0099999999999998 110.17 -176.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 619' ' ' ASN . . . . . 0.455 ' N ' HG23 ' B' ' 618' ' ' ILE . 78.2 m-20 -63.2 -51.05 67.88 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 113.785 1.031 . . . . 2.2799999999999998 113.785 -176.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 48.5 p -56.97 -31.83 65.42 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 119.432 -0.907 . . . . 1.3200000000000001 110.708 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 621' ' ' ILE . . . . . 0.494 HG12 ' O ' ' B' ' 618' ' ' ILE . 27.7 pt -79.3 -42.68 23.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.282 1.586 . . . . 2.0 115.282 -178.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 622' ' ' ILE . . . . . 0.708 ' HA ' HD13 ' B' ' 625' ' ' LEU . 2.8 pp -87.72 -6.21 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 115.035 1.494 . . . . 2.0899999999999999 115.035 -177.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 18.9 p -20.03 -58.34 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 116.493 2.035 . . . . 1.47 116.493 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.23 -7.58 26.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.011 -1.45 . . . . 2.0699999999999998 111.022 -163.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 625' ' ' LEU . . . . . 0.82 HD11 ' HB3' ' B' ' 573' ' ' MET . 9.1 mp -71.83 146.9 47.69 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 123.3 0.375 . . . . 1.6699999999999999 111.662 -173.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 626' ' ' GLN . . . . . 0.433 ' O ' HG23 ' B' ' 630' ' ' VAL . 1.8 mp0 -76.85 162.1 71.45 Favored Pre-proline 0 N--CA 1.464 0.254 0 N-CA-C 108.794 -0.817 . . . . 2.3500000000000001 108.794 174.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -47.78 -43.67 28.48 Favored 'Trans proline' 0 C--O 1.233 0.256 0 N-CA-C 115.799 1.423 . . . . 0.44 115.799 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -67.24 -43.03 82.97 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.423 -0.511 . . . . 2.6200000000000001 109.66 -174.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -63.27 -38.34 90.78 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 115.98 -0.555 . . . . 2.0600000000000001 110.923 178.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 630' ' ' VAL . . . . . 0.433 HG23 ' O ' ' B' ' 626' ' ' GLN . 97.8 t . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.163 -0.922 . . . . 1.3 110.722 176.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.196 0 N-CA-C 112.404 -0.278 . . . . 9.8599999999999994 112.404 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.2 t -147.9 119.17 7.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.732 0.301 . . . . 8.7799999999999994 110.866 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 56.16 78.67 0.19 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.096 -0.502 . . . . 6.8200000000000003 111.097 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.4 m -98.17 22.89 8.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 6.25 110.823 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -85.88 48.39 3.96 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.717 -0.754 . . . . 4.1200000000000001 112.466 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -138.32 -9.55 1.48 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.783 0.325 . . . . 4.0300000000000002 110.995 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.617 HD21 ' HB2' ' B' ' 561' ' ' PHE . 1.7 tp -59.7 -19.71 51.56 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.221 -0.445 . . . . 2.21 110.9 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -58.4 -42.42 87.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.213 -0.449 . . . . 3.79 111.249 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -66.85 -20.83 66.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.828 0.347 . . . . 4.1699999999999999 110.873 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.547 HD12 HD12 ' A' ' 7' ' ' LEU . 48.4 mt -78.72 -28.88 45.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.125 -0.488 . . . . 2.5800000000000001 110.683 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.59 -36.8 79.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.476 . . . . 2.8399999999999999 111.398 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.32 -9.97 59.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.277 -0.419 . . . . 3.6699999999999999 111.407 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 37.3 tptt -80.45 -50.15 10.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.569 -0.287 . . . . 4.9299999999999997 111.176 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.44 HD11 ' HG2' ' B' ' 568' ' ' LYS . 59.7 tp -79.46 -23.76 42.85 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.537 -0.301 . . . . 3.27 110.871 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.57 -16.12 45.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.285 -0.416 . . . . 3.1299999999999999 111.281 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -126.61 39.05 2.06 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.89 -0.672 . . . . 2.4700000000000002 112.606 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.486 ' HB3' ' HD3' ' B' ' 568' ' ' LYS . 62.4 tp -71.4 121.12 18.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.798 0.332 . . . . 2.1400000000000001 110.431 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -98.37 169.34 9.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.084 -0.507 . . . . 3.9199999999999999 111.378 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.65 HG13 ' HB2' ' B' ' 537' ' ' LYS . 13.8 tt -167.27 -34.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.685 -0.689 . . . . 3.25 110.363 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -115.87 19.5 15.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.962 -0.563 . . . . 5.9500000000000002 110.514 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 97.2 mttt 60.2 172.74 0.09 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.922 -0.581 . . . . 9.3900000000000006 111.295 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.4 p -133.53 -43.49 0.84 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.104 -0.498 . . . . 8.9700000000000006 111.084 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.429 ' H ' ' H ' ' A' ' 24' ' ' GLY . 11.8 pt-20 -167.26 -15.07 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.133 -0.485 . . . . 11.67 110.93 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.429 ' H ' ' H ' ' A' ' 23' ' ' GLU . . . 88.27 136.46 5.41 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.849 -0.691 . . . . 12.859999999999999 112.593 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 57.14 89.21 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.894 0.378 . . . . 15.369999999999999 111.16 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -81.87 104.52 12.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.112 -0.495 . . . . 16.539999999999999 110.921 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.4 p . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.209 -0.9 . . . . 17.93 110.923 -179.975 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 504' ' ' ILE . . . . . 0.436 ' N ' HD13 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.236 0.386 0 N-CA-C 113.063 0.764 . . . . 2.1299999999999999 113.063 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 505' ' ' SER . . . . . 0.464 ' HB3' ' HG3' ' B' ' 550' ' ' GLN . 79.8 p -48.85 119.11 2.95 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.549 0.574 . . . . 1.29 112.549 174.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.88 1.43 67.69 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.964 -0.636 . . . . 0.0 114.407 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.55 41.43 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.646 0.723 . . . . 0.02 112.443 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 54.6 mtt -112.42 160.01 18.16 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 112.32 0.489 . . . . 2.21 112.32 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -69.78 134.21 48.3 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.131 -0.692 . . . . 2.6699999999999999 109.131 174.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -41.72 -35.44 0.79 Allowed 'General case' 0 C--O 1.241 0.623 0 N-CA-C 113.361 0.874 . . . . 2.6600000000000001 113.361 -173.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -73.67 -41.98 61.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.546 -0.752 . . . . 2.4399999999999999 112.152 -176.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -64.83 -40.11 94.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.145 0.498 . . . . 2.0800000000000001 110.885 171.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 513' ' ' GLU . . . . . 0.524 ' HG3' HD23 ' B' ' 517' ' ' LEU . 9.1 tp10 -53.71 -48.66 69.36 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.365 -0.834 . . . . 1.9199999999999999 111.108 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 514' ' ' LYS . . . . . 0.528 ' O ' ' HG ' ' B' ' 517' ' ' LEU . 62.9 mttp -54.81 -57.57 11.05 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 111.918 0.34 . . . . 2.73 111.918 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 515' ' ' ARG . . . . . 0.442 ' O ' HG12 ' B' ' 518' ' ' VAL . 39.8 ttm180 -56.61 -36.0 68.93 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 124.201 0.938 . . . . 3.75 111.092 -177.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.506 ' O ' HG23 ' B' ' 520' ' ' VAL . 88.8 t80 -76.02 -45.64 33.45 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.06 -0.973 . . . . 1.8899999999999999 110.554 -173.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 517' ' ' LEU . . . . . 0.566 HD12 ' N ' ' B' ' 518' ' ' VAL . 4.4 pp -66.63 -32.26 73.47 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.708 -0.678 . . . . 1.8999999999999999 112.674 177.087 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 518' ' ' VAL . . . . . 0.566 ' N ' HD12 ' B' ' 517' ' ' LEU . 7.7 p -67.53 -35.09 72.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 118.483 -1.287 . . . . 1.3999999999999999 109.047 178.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 60.8 p -73.01 -36.33 66.99 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.1799999999999999 112.391 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 520' ' ' VAL . . . . . 0.506 HG23 ' O ' ' B' ' 516' ' ' PHE . 56.0 t -71.23 -42.37 75.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.46 -0.336 . . . . 1.22 111.611 -174.421 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 521' ' ' ILE . . . . . 0.52 HG22 ' O ' ' B' ' 517' ' ' LEU . 14.5 tt -90.64 -25.75 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.492 1.664 . . . . 1.98 115.492 -175.116 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -60.83 -35.28 76.15 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.683 -0.858 . . . . 2.5699999999999998 108.683 173.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -92.36 -21.5 20.21 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.02 1.489 . . . . 2.1699999999999999 115.02 -177.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 524' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' B' ' 520' ' ' VAL . 84.2 mt -70.58 -45.46 65.34 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 109.28 -0.637 . . . . 1.48 109.28 168.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 84.6 mt -52.18 -45.46 65.15 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-O 121.329 0.585 . . . . 1.95 110.97 169.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 526' ' ' GLY . . . . . 0.426 ' O ' ' HG2' ' B' ' 529' ' ' GLU . . . -66.5 -40.59 94.34 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 -178.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 67.2 mt -63.57 -36.07 82.6 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 1.6699999999999999 111.47 175.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 528' ' ' CYS . . . . . 0.455 ' SG ' HD11 ' A' ' 17' ' ' LEU . 47.6 t -63.55 -47.73 80.37 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.08 -0.509 . . . . 0.58999999999999997 110.661 -175.269 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 529' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' B' ' 526' ' ' GLY . 11.1 pt-20 -61.71 -29.59 70.2 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.508 -0.769 . . . . 2.5 112.589 173.796 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -71.61 -54.84 9.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.322 0.86 . . . . 2.2400000000000002 113.322 -177.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 531' ' ' LYS . . . . . 0.465 ' O ' ' HD3' ' B' ' 537' ' ' LYS . 31.6 mmmt -68.71 137.87 54.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.994 -0.548 . . . . 2.2799999999999998 111.047 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 19.1 ptt180 -96.37 160.67 14.29 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.79 -0.641 . . . . 4.21 110.149 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.39 119.58 1.34 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.841 -0.618 . . . . 0.0 114.008 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 534' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 19' ' ' ILE . 51.5 mtmt -47.06 -36.63 8.32 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.248 0.832 . . . . 2.9500000000000002 113.248 177.269 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -50.53 -51.89 43.68 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.397 -0.521 . . . . 2.2000000000000002 110.824 174.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 536' ' ' ASN . . . . . 0.424 ' O ' ' CG1' ' B' ' 539' ' ' ILE . 32.0 m-80 -65.98 -44.86 83.64 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.697 0.628 . . . . 1.47 112.697 178.265 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 537' ' ' LYS . . . . . 0.65 ' HB2' HG13 ' A' ' 19' ' ' ILE . 5.3 mmmm -67.84 -32.02 72.26 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.263 -174.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.03 -47.04 69.52 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 115.889 -0.596 . . . . 0.040000000000000001 111.156 178.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 539' ' ' ILE . . . . . 0.47 HG13 ' N ' ' B' ' 540' ' ' ILE . 43.5 pt -58.15 -54.93 25.79 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 1.8200000000000001 111.224 173.446 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 540' ' ' ILE . . . . . 0.47 ' N ' HG13 ' B' ' 539' ' ' ILE . 87.1 mt -56.85 -48.09 81.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 121.7 -0.625 . . . . 1.8500000000000001 110.57 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 541' ' ' ALA . . . . . 0.475 ' O ' HG12 ' B' ' 544' ' ' ILE . . . -57.35 -44.17 84.1 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 113.678 0.992 . . . . 0.02 113.678 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 95.8 p -60.33 -38.83 84.97 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 120.658 -0.417 . . . . 1.2 110.294 -178.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -69.0 -47.12 66.28 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.339 1.237 . . . . 2.0299999999999998 114.339 -175.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 544' ' ' ILE . . . . . 0.53 HG13 ' N ' ' B' ' 545' ' ' MET . 47.1 pt -52.69 -45.89 49.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.515 -0.921 . . . . 1.8100000000000001 108.515 170.075 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 545' ' ' MET . . . . . 0.818 ' HB3' HG21 ' B' ' 587' ' ' THR . 77.0 mtm -64.06 -42.34 97.04 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.761 -0.776 . . . . 2.6000000000000001 112.786 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -58.26 -48.82 79.23 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 119.279 -0.969 . . . . 2.0800000000000001 109.857 176.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 28.9 mm -55.04 -61.41 1.05 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 112.862 0.69 . . . . 1.5 112.862 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 548' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' B' ' 545' ' ' MET . 33.4 m -47.32 -44.18 8.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 C-N-CA 119.872 -0.731 . . . . 1.3999999999999999 111.498 176.169 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.53 -27.95 59.07 Favored Glycine 0 C--N 1.331 0.285 0 O-C-N 121.835 -0.541 . . . . 0.0 112.851 -177.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 550' ' ' GLN . . . . . 0.464 ' HG3' ' HB3' ' B' ' 505' ' ' SER . 21.8 tp60 -87.13 -9.52 55.09 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.613 0.598 . . . . 2.27 112.613 -175.346 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 551' ' ' TYR . . . . . 0.482 ' O ' HD23 ' B' ' 555' ' ' LEU . 74.3 m-85 -120.36 59.72 6.98 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.809 1.04 . . . . 3.5299999999999998 113.809 -177.024 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.01 -39.3 92.03 Favored 'Trans proline' 0 CA--C 1.53 0.298 0 O-C-N 122.127 0.54 . . . . 0.46000000000000002 113.143 177.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 15.5 ptp180 -56.35 -46.71 79.84 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 121.095 0.474 . . . . 3.8700000000000001 109.931 -174.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -48.89 -59.8 3.28 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 123.958 0.903 . . . . 0.69999999999999996 112.113 167.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 555' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' B' ' 562' ' ' LEU . 4.4 mm? -54.34 -48.51 71.33 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 116.242 -0.436 . . . . 1.49 110.236 -178.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 63.1 mtp180 -53.93 -35.79 62.09 Favored 'General case' 0 C--O 1.243 0.757 0 N-CA-C 113.828 1.047 . . . . 3.0899999999999999 113.828 -178.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.13 -12.14 50.74 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.486 -0.486 . . . . 0.0 112.058 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 558' ' ' HIS . . . . . 0.429 ' ND1' HD22 ' A' ' 7' ' ' LEU . 86.8 m-70 -128.27 78.51 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.399 1.259 . . . . 2.9300000000000002 114.399 -177.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 559' ' ' TRP . . . . . 0.504 ' O ' ' HG2' ' B' ' 563' ' ' LYS . 31.8 m-90 -50.46 -48.32 56.56 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 116.563 2.06 . . . . 3.1099999999999999 116.563 -176.088 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 560' ' ' LYS . . . . . 0.426 ' O ' HG23 ' B' ' 564' ' ' THR . 63.6 mttp -56.67 -36.6 69.77 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.314 -0.403 . . . . 3.3199999999999998 111.13 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 561' ' ' PHE . . . . . 0.617 ' HB2' HD21 ' A' ' 7' ' ' LEU . 2.6 t80 -74.94 -45.08 44.83 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 119.087 -1.045 . . . . 1.25 111.847 175.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 562' ' ' LEU . . . . . 0.633 ' HA ' HD12 ' B' ' 555' ' ' LEU . 2.1 tt -50.0 -59.11 4.2 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.466 0.306 . . . . 1.3200000000000001 110.29 175.094 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 563' ' ' LYS . . . . . 0.527 ' O ' HG12 ' B' ' 566' ' ' VAL . 11.0 mmpt? -50.22 -38.67 41.48 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.863 1.061 . . . . 2.7400000000000002 113.863 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 564' ' ' THR . . . . . 0.426 HG23 ' O ' ' B' ' 560' ' ' LYS . 24.0 p -71.79 -39.33 69.98 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.495 0.664 . . . . 1.24 110.408 -176.107 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 565' ' ' VAL . . . . . 0.458 HG23 ' O ' ' B' ' 561' ' ' PHE . 97.9 t -62.83 -41.32 92.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.617 -0.72 . . . . 1.1899999999999999 112.502 173.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 566' ' ' VAL . . . . . 0.527 HG12 ' O ' ' B' ' 563' ' ' LYS . 11.5 p -71.06 -50.74 40.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 C-N-CA 120.451 -0.499 . . . . 1.3600000000000001 110.872 -176.476 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 567' ' ' ASN . . . . . 0.442 ' N ' HG13 ' B' ' 566' ' ' VAL . 6.7 t30 -51.13 -37.42 45.97 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.067 -0.515 . . . . 1.9399999999999999 112.006 170.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 568' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' B' ' 568' ' ' LYS . 0.3 OUTLIER -72.6 -32.7 66.17 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.746 -0.465 . . . . 3.5299999999999998 109.746 -179.234 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 569' ' ' LEU . . . . . 0.447 ' O ' ' HG3' ' B' ' 573' ' ' MET . 4.1 mp -67.43 -36.52 81.39 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.67 -0.863 . . . . 2.0099999999999998 108.67 177.103 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 570' ' ' PHE . . . . . 0.406 ' CE2' HG22 ' B' ' 566' ' ' VAL . 19.5 m-85 -65.38 -39.28 92.06 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.907 -0.405 . . . . 3.77 109.907 178.346 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.73 -53.47 57.79 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 119.921 -0.711 . . . . 2.4700000000000002 110.51 176.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 572' ' ' PHE . . . . . 0.444 ' CE2' HD23 ' A' ' 17' ' ' LEU . 34.3 m-85 -62.49 -9.92 10.11 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.056 1.132 . . . . 1.23 114.056 -177.146 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 573' ' ' MET . . . . . 0.878 ' HB3' HD11 ' B' ' 625' ' ' LEU . 67.7 mtt -76.42 -5.31 46.75 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.618 0.723 . . . . 2.1099999999999999 109.625 178.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 30.0 m-70 -109.42 -0.51 18.91 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.842 -1.072 . . . . 3.2000000000000002 111.502 173.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 575' ' ' GLU . . . . . 0.42 ' HG2' HG11 ' B' ' 580' ' ' VAL . 13.0 tp10 -68.55 130.26 42.35 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.15 -0.477 . . . . 1.55 110.137 177.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 81.8 p -87.89 -21.27 25.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 112.981 0.734 . . . . 1.3999999999999999 112.981 -177.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -60.2 128.01 34.67 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.411 0.624 . . . . 2.8500000000000001 112.578 -175.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -44.9 125.88 5.4 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.388 -0.824 . . . . 2.1499999999999999 113.103 -171.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.22 -34.64 4.82 Favored Glycine 0 C--O 1.223 -0.553 0 N-CA-C 116.242 1.257 . . . . 0.0 116.242 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 580' ' ' VAL . . . . . 0.42 HG11 ' HG2' ' B' ' 575' ' ' GLU . 93.9 t -53.81 -46.27 63.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.232 0.827 . . . . 1.29 113.232 -175.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -59.77 -42.18 92.76 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.361 0.504 . . . . 1.99 112.361 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -60.56 -42.39 96.5 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.209 0.448 . . . . 2.23 112.209 172.065 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 26.4 mmt -60.76 -49.46 77.42 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 121.043 -0.263 . . . . 2.5800000000000001 110.402 175.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.92 80.2 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.265 -0.425 . . . . 0.029999999999999999 111.783 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 585' ' ' CYS . . . . . 0.417 ' O ' HG13 ' B' ' 589' ' ' ILE . 28.8 p -74.39 -40.98 61.7 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 120.066 -0.654 . . . . 1.5 111.929 -177.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -59.56 -46.35 89.16 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.209 -0.45 . . . . 1.98 111.962 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 587' ' ' THR . . . . . 0.818 HG21 ' HB3' ' B' ' 545' ' ' MET . 29.3 p -62.19 -41.23 98.14 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.298 0.639 . . . . 1.3 110.42 175.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -61.4 -32.25 72.18 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.059 -0.519 . . . . 0.53000000000000003 111.177 -177.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 589' ' ' ILE . . . . . 0.417 HG13 ' O ' ' B' ' 585' ' ' CYS . 74.4 mt -79.81 -35.97 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 C-N-CA 116.91 -1.916 . . . . 1.97 109.831 -175.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -57.48 -49.99 74.49 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 107.717 -1.216 . . . . 2.6200000000000001 107.717 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 591' ' ' ILE . . . . . 0.42 HG12 ' O ' ' B' ' 587' ' ' THR . 49.0 mm -63.86 -43.71 97.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.697 -0.683 . . . . 1.96 112.779 -176.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.96 -39.13 93.44 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.512 -0.475 . . . . 0.0 112.252 177.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -62.34 -70.12 0.22 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 119.129 -1.029 . . . . 2.3599999999999999 109.825 174.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -56.19 -23.65 36.62 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 116.617 2.08 . . . . 2.1899999999999999 116.617 -176.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.4 p -121.79 25.29 9.29 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.189 1.181 . . . . 1.26 114.189 -178.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -48.54 -38.58 20.84 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 115.841 1.793 . . . . 3.5800000000000001 115.841 -172.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 597' ' ' ARG . . . . . 0.427 ' O ' HG22 ' B' ' 600' ' ' VAL . 96.8 mtt180 -69.47 -32.64 71.68 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.302 0.852 . . . . 3.7400000000000002 113.302 -175.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -70.19 -3.78 18.48 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.523 -0.762 . . . . 2.1400000000000001 112.032 -173.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -105.6 -16.87 14.58 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.633 0.583 . . . . 2.9500000000000002 110.197 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 600' ' ' VAL . . . . . 0.427 HG22 ' O ' ' B' ' 597' ' ' ARG . 33.2 m -105.82 -24.39 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.037 -0.983 . . . . 1.4199999999999999 111.327 -175.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 601' ' ' GLN . . . . . 0.417 ' HG2' HG23 ' B' ' 600' ' ' VAL . 14.2 mm100 -101.98 139.49 37.54 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.535 -0.866 . . . . 2.3399999999999999 111.635 176.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 43.9 t -60.87 122.76 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 108.561 -0.903 . . . . 1.3700000000000001 108.561 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 603' ' ' GLN . . . . . 0.476 ' NE2' ' HB3' ' B' ' 559' ' ' TRP . 4.0 pt20 -92.8 167.33 11.93 Favored 'General case' 0 C--O 1.224 -0.263 0 O-C-N 123.673 0.608 . . . . 2.6800000000000002 110.116 -177.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 15.6 m -72.0 128.97 35.51 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 N-CA-C 112.98 0.733 . . . . 1.27 112.98 -175.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.33 6.57 64.43 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.11 -175.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 606' ' ' GLU . . . . . 0.572 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.3 tp10 -131.48 158.06 41.88 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.641 -0.824 . . . . 2.5099999999999998 110.757 175.56 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 5.3 t -103.32 -22.58 4.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.036 -0.984 . . . . 1.3999999999999999 112.472 -175.124 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 608' ' ' MET . . . . . 0.572 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 20.0 ptm -136.97 142.1 37.22 Favored Pre-proline 0 C--O 1.223 -0.297 0 N-CA-C 112.712 0.634 . . . . 2.6800000000000002 112.712 -174.254 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 609' ' ' PRO . . . . . 0.536 ' HB2' HG22 ' B' ' 611' ' ' ILE . 9.6 Cg_endo -51.91 130.8 35.92 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 120.902 1.068 . . . . 0.42999999999999999 112.202 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -57.0 -31.74 65.39 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.794 0.294 . . . . 2.3700000000000001 111.794 -174.103 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 611' ' ' ILE . . . . . 0.536 HG22 ' HB2' ' B' ' 609' ' ' PRO . 12.2 tt -50.16 -44.74 23.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 CA-C-O 120.782 0.325 . . . . 1.8400000000000001 110.493 178.287 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 612' ' ' ASP . . . . . 0.415 ' OD1' ' HG2' ' B' ' 609' ' ' PRO . 1.0 OUTLIER -50.04 -51.99 37.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.587 0.755 . . . . 2.1499999999999999 112.849 177.72 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -59.88 -37.1 78.41 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.604 -0.438 . . . . 2.6600000000000001 110.21 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 614' ' ' ILE . . . . . 0.439 ' O ' ' ND2' ' B' ' 617' ' ' ASN . 67.5 mt -64.6 -47.93 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 120.233 -0.587 . . . . 1.76 111.963 178.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 51.7 tp -62.66 -31.19 72.01 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.946 0.721 . . . . 1.8400000000000001 112.946 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -79.47 2.12 23.14 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.632 1.345 . . . . 2.0600000000000001 114.632 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 617' ' ' ASN . . . . . 0.46 ' ND2' ' C ' ' B' ' 617' ' ' ASN . 0.0 OUTLIER -142.47 15.79 2.01 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 113.141 0.793 . . . . 1.97 113.141 -174.248 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 618' ' ' ILE . . . . . 0.489 HG13 ' N ' ' B' ' 619' ' ' ASN . 19.7 pt -46.99 -47.06 8.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 C-N-CA 118.949 -1.1 . . . . 2.0099999999999998 110.139 -176.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 619' ' ' ASN . . . . . 0.489 ' N ' HG13 ' B' ' 618' ' ' ILE . 6.3 p30 -63.21 -51.05 67.85 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.769 1.026 . . . . 2.2799999999999998 113.769 -176.355 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 62.9 p -56.89 -31.86 65.29 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 119.539 -0.864 . . . . 1.3200000000000001 110.774 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 621' ' ' ILE . . . . . 0.475 HG13 HG23 ' B' ' 622' ' ' ILE . 49.2 pt -79.36 -42.6 23.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 115.385 1.624 . . . . 2.0 115.385 -179.008 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 622' ' ' ILE . . . . . 0.72 ' HA ' HD13 ' B' ' 625' ' ' LEU . 43.5 pt -87.74 -6.24 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 115.005 1.483 . . . . 2.0899999999999999 115.005 -177.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 66.8 m -19.91 -58.38 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.543 2.053 . . . . 1.47 116.543 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -99.27 -7.63 26.13 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.983 -1.462 . . . . 2.0699999999999998 111.022 -163.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 625' ' ' LEU . . . . . 0.878 HD11 ' HB3' ' B' ' 573' ' ' MET . 8.8 mp -71.84 146.93 47.64 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 123.289 0.368 . . . . 1.6699999999999999 111.687 -173.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 626' ' ' GLN . . . . . 0.531 ' HB3' ' HD2' ' B' ' 627' ' ' PRO . 49.2 mt-30 -76.84 162.1 71.47 Favored Pre-proline 0 CA--C 1.518 -0.262 0 N-CA-C 108.818 -0.808 . . . . 2.3500000000000001 108.818 174.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 627' ' ' PRO . . . . . 0.531 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 6.1 Cg_endo -47.84 -43.62 28.91 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.813 1.428 . . . . 0.44 115.813 -178.385 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 27.7 mp0 -67.28 -43.03 82.78 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.396 -0.522 . . . . 2.6200000000000001 109.602 -174.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 21.4 mm-40 -63.25 -38.3 90.61 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.968 -0.56 . . . . 2.0600000000000001 110.92 178.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 630' ' ' VAL . . . . . 0.425 HG23 ' O ' ' B' ' 626' ' ' GLN . 93.5 t . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.22 -0.895 . . . . 1.3 110.644 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 112.399 -0.28 . . . . 9.8599999999999994 112.399 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.5 p -91.95 128.06 37.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.698 0.285 . . . . 8.7799999999999994 111.028 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -161.15 86.93 0.7 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 6.8200000000000003 111.051 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.8 p -91.52 11.33 24.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 6.25 111.131 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 153.2 62.71 0.01 OUTLIER Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.736 -0.745 . . . . 4.1200000000000001 112.502 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -114.68 -9.94 12.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.965 0.412 . . . . 4.0300000000000002 110.78 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.581 HD12 HD12 ' A' ' 10' ' ' LEU . 1.9 tp -71.38 -17.68 62.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.02 -0.536 . . . . 2.21 110.874 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -66.38 -32.91 74.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.132 -0.486 . . . . 3.79 111.337 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -79.88 -18.7 50.02 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.303 -0.408 . . . . 4.1699999999999999 111.245 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.581 HD12 HD12 ' A' ' 7' ' ' LEU . 20.8 mt -76.35 -35.84 58.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 2.5800000000000001 110.912 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.72 -40.53 69.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.091 -0.504 . . . . 2.8399999999999999 111.559 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 65.0 tp -62.86 -21.58 66.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.312 -0.404 . . . . 3.6699999999999999 111.16 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -79.31 -26.69 42.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.43 . . . . 4.9299999999999997 111.109 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.436 HD11 ' HD3' ' B' ' 568' ' ' LYS . 60.5 tp -64.4 -18.42 64.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.392 -0.367 . . . . 3.27 111.054 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.7 -27.74 63.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.244 -0.435 . . . . 3.1299999999999999 111.28 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -85.41 88.39 1.58 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.699 -0.762 . . . . 2.4700000000000002 112.576 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -159.81 94.75 1.15 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.855 0.36 . . . . 2.1400000000000001 110.506 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -130.62 140.89 50.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.063 -0.517 . . . . 3.9199999999999999 110.816 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.438 HD13 ' HA ' ' B' ' 538' ' ' ALA . 17.3 mt -134.88 68.67 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.337 -0.392 . . . . 3.25 110.802 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -134.23 146.99 50.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.154 -0.476 . . . . 5.9500000000000002 110.989 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -151.36 88.37 1.43 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.98 -0.555 . . . . 9.3900000000000006 110.248 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.7 p 53.99 -176.25 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.064 -0.516 . . . . 8.9700000000000006 111.364 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 36.86 69.23 0.22 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.064 -0.516 . . . . 11.67 111.727 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -105.2 -78.34 1.2 Allowed Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.792 -0.718 . . . . 12.859999999999999 112.553 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -75.4 -6.05 48.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.801 0.334 . . . . 15.369999999999999 110.867 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -96.74 -59.87 1.72 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.161 -0.472 . . . . 16.539999999999999 110.877 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.5 t . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.276 -0.869 . . . . 17.93 111.075 -179.889 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 504' ' ' ILE . . . . . 0.494 ' N ' HD13 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.291 0 N-CA-C 113.112 0.782 . . . . 2.1299999999999999 113.112 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 77.9 p -48.89 119.2 3.02 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.548 0.573 . . . . 1.29 112.548 174.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.78 1.51 67.89 Favored Glycine 0 CA--C 1.526 0.741 0 C-N-CA 120.948 -0.644 . . . . 0.0 114.468 -179.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.52 41.51 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.653 0.727 . . . . 0.02 112.456 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -112.5 160.02 18.2 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 121.196 0.522 . . . . 2.21 112.214 174.159 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -69.78 134.19 48.29 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.056 -0.72 . . . . 2.6699999999999999 109.056 174.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 510' ' ' GLU . . . . . 0.485 ' O ' ' HG3' ' B' ' 514' ' ' LYS . 38.7 mt-10 -41.62 -35.33 0.73 Allowed 'General case' 0 C--O 1.24 0.565 0 N-CA-C 113.498 0.925 . . . . 2.6600000000000001 113.498 -173.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -73.87 -41.94 61.49 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.485 -0.78 . . . . 2.4399999999999999 112.086 -176.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -64.93 -40.03 94.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.133 0.492 . . . . 2.0800000000000001 110.862 171.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 513' ' ' GLU . . . . . 0.438 ' O ' HD23 ' B' ' 517' ' ' LEU . 43.6 mt-10 -53.77 -48.55 69.65 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.344 -0.843 . . . . 1.9199999999999999 111.155 177.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 514' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' B' ' 510' ' ' GLU . 67.1 mttm -54.92 -57.62 10.92 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 116.476 -0.329 . . . . 2.73 111.852 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 515' ' ' ARG . . . . . 0.494 ' O ' HG22 ' B' ' 518' ' ' VAL . 5.8 tmm_? -56.59 -35.97 68.84 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.173 0.921 . . . . 3.75 111.086 -177.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -76.06 -45.59 33.42 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.118 -0.947 . . . . 1.8899999999999999 110.535 -173.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 517' ' ' LEU . . . . . 0.618 ' O ' HG22 ' B' ' 521' ' ' ILE . 4.5 mm? -66.75 -32.23 73.39 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.742 -0.663 . . . . 1.8999999999999999 112.627 177.137 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 518' ' ' VAL . . . . . 0.494 HG22 ' O ' ' B' ' 515' ' ' ARG . 35.9 m -67.48 -35.17 72.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 118.535 -1.266 . . . . 1.3999999999999999 109.034 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 42.2 m -72.89 -36.42 67.33 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.428 0.633 . . . . 1.1799999999999999 112.42 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 520' ' ' VAL . . . . . 0.57 HG12 ' HA ' ' B' ' 517' ' ' LEU . 7.1 p -71.19 -42.32 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 O-C-N 122.115 -0.366 . . . . 1.22 111.663 -174.4 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 521' ' ' ILE . . . . . 0.618 HG22 ' O ' ' B' ' 517' ' ' LEU . 14.3 tt -90.71 -25.7 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.473 1.657 . . . . 1.98 115.473 -175.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 6.1 tmmm? -60.86 -35.24 76.09 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.666 -0.864 . . . . 2.5699999999999998 108.666 173.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -92.41 -21.54 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.008 1.484 . . . . 2.1699999999999999 115.008 -177.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 80.5 mt -70.52 -45.44 65.56 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.315 -0.624 . . . . 1.48 109.315 168.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 85.0 mt -52.23 -45.42 65.28 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-O 121.273 0.559 . . . . 1.95 110.971 169.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.56 -40.48 94.21 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 -178.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 66.3 mt -63.7 -36.08 82.67 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.021 0.439 . . . . 1.6699999999999999 111.382 175.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 40.7 t -63.47 -47.74 80.55 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.104 -0.498 . . . . 0.58999999999999997 110.706 -175.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.7 -29.64 70.23 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.446 -0.797 . . . . 2.5 112.578 173.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -71.58 -54.76 9.43 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 113.384 0.883 . . . . 2.2400000000000002 113.384 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -68.75 137.87 54.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.937 -0.574 . . . . 2.2799999999999998 111.047 -177.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 532' ' ' ARG . . . . . 0.605 ' HD3' ' HZ1' ' B' ' 537' ' ' LYS . 21.7 tpp180 -96.42 160.73 14.25 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.798 -0.637 . . . . 4.21 110.166 178.417 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.62 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.854 -0.612 . . . . 0.0 114.022 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -47.08 -36.66 8.46 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.196 0.813 . . . . 2.9500000000000002 113.196 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -50.51 -51.86 43.75 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 120.367 -0.533 . . . . 2.2000000000000002 110.857 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 536' ' ' ASN . . . . . 0.499 ' O ' HG22 ' B' ' 539' ' ' ILE . 0.2 OUTLIER -66.13 -44.78 83.23 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.603 0.594 . . . . 1.47 112.603 178.359 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 537' ' ' LYS . . . . . 0.605 ' HZ1' ' HD3' ' B' ' 532' ' ' ARG . 62.6 mttp -67.87 -31.94 72.09 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.272 -174.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 538' ' ' ALA . . . . . 0.438 ' HA ' HD13 ' A' ' 19' ' ' ILE . . . -68.17 -46.96 69.29 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.886 -0.597 . . . . 0.040000000000000001 111.092 178.462 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 539' ' ' ILE . . . . . 0.499 HG22 ' O ' ' B' ' 536' ' ' ASN . 8.2 tp -58.22 -54.91 26.09 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 1.8200000000000001 111.247 173.455 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 540' ' ' ILE . . . . . 0.425 ' N ' HG23 ' B' ' 539' ' ' ILE . 48.4 mm -56.79 -48.06 81.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.607 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.51 -44.06 84.72 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 113.645 0.98 . . . . 0.02 113.645 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 94.9 p -60.35 -38.88 85.22 Favored 'General case' 0 C--O 1.22 -0.478 0 C-N-CA 120.6 -0.44 . . . . 1.2 110.3 -178.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -68.95 -47.17 66.33 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 114.323 1.231 . . . . 2.0299999999999998 114.323 -175.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 544' ' ' ILE . . . . . 0.451 HG23 HG13 ' B' ' 521' ' ' ILE . 85.2 mt -52.55 -45.94 47.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.586 -0.894 . . . . 1.8100000000000001 108.586 169.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 545' ' ' MET . . . . . 0.453 ' HA ' HG12 ' B' ' 548' ' ' VAL . 74.2 mtm -64.03 -42.29 97.14 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.763 -0.775 . . . . 2.6000000000000001 112.818 179.4 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -58.34 -48.8 79.42 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 119.234 -0.986 . . . . 2.0800000000000001 109.838 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 95.0 mt -55.07 -61.41 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 112.846 0.684 . . . . 1.5 112.846 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 548' ' ' VAL . . . . . 0.633 HG23 HD21 ' B' ' 555' ' ' LEU . 10.5 p -47.36 -44.21 8.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.838 -0.745 . . . . 1.3999999999999999 111.442 176.213 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 549' ' ' GLY . . . . . 0.535 ' HA2' HD11 ' B' ' 591' ' ' ILE . . . -57.41 -28.08 58.9 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -87.01 -9.53 55.33 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 112.629 0.604 . . . . 2.27 112.629 -175.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 551' ' ' TYR . . . . . 0.543 ' O ' HD23 ' B' ' 555' ' ' LEU . 80.2 m-85 -120.46 59.66 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.796 1.035 . . . . 3.5299999999999998 113.796 -176.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 552' ' ' PRO . . . . . 0.549 ' HG3' ' HG2' ' B' ' 594' ' ' LYS . 13.3 Cg_endo -55.93 -39.43 91.19 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 O-C-N 122.087 0.52 . . . . 0.46000000000000002 113.114 177.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -56.26 -46.77 79.52 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 121.145 0.498 . . . . 3.8700000000000001 109.926 -174.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -48.98 -59.71 3.38 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 123.953 0.901 . . . . 0.69999999999999996 112.046 168.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 555' ' ' LEU . . . . . 0.633 HD21 HG23 ' B' ' 548' ' ' VAL . 4.3 mm? -54.3 -48.66 71.04 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 116.334 -0.394 . . . . 1.49 110.158 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 556' ' ' ARG . . . . . 0.571 ' HG3' ' HE2' ' B' ' 598' ' ' HIS . 21.3 ttm180 -53.87 -35.8 61.94 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.857 1.058 . . . . 3.0899999999999999 113.857 -178.255 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.1 -12.22 50.64 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.48 -0.488 . . . . 0.0 112.043 -177.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 70.9 m-70 -128.19 78.47 1.84 Allowed 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.404 1.261 . . . . 2.9300000000000002 114.404 -177.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 47.1 p90 -50.47 -48.28 56.71 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 116.59 2.07 . . . . 3.1099999999999999 116.59 -176.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 560' ' ' LYS . . . . . 0.426 ' O ' HG23 ' B' ' 564' ' ' THR . 63.5 tttm -56.7 -36.61 69.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 3.3199999999999998 111.099 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 561' ' ' PHE . . . . . 0.449 ' O ' HG23 ' B' ' 565' ' ' VAL . 1.7 t80 -74.91 -45.15 44.61 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 119.163 -1.015 . . . . 1.25 111.847 175.641 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 562' ' ' LEU . . . . . 0.595 ' HA ' HD12 ' B' ' 555' ' ' LEU . 5.5 tt -49.96 -59.18 4.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.498 0.319 . . . . 1.3200000000000001 110.229 175.093 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 563' ' ' LYS . . . . . 0.466 ' HA ' HG22 ' B' ' 566' ' ' VAL . 39.7 tttm -50.2 -38.63 40.92 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.831 1.049 . . . . 2.7400000000000002 113.831 178.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 564' ' ' THR . . . . . 0.426 HG23 ' O ' ' B' ' 560' ' ' LYS . 23.3 p -71.81 -39.36 69.89 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.5 0.667 . . . . 1.24 110.366 -176.065 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 565' ' ' VAL . . . . . 0.449 HG23 ' O ' ' B' ' 561' ' ' PHE . 99.6 t -62.88 -41.28 92.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.628 -0.714 . . . . 1.1899999999999999 112.49 173.415 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 566' ' ' VAL . . . . . 0.717 ' HA ' HD23 ' B' ' 569' ' ' LEU . 30.3 m -71.01 -50.9 39.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 C-N-CA 120.485 -0.486 . . . . 1.3600000000000001 110.793 -176.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 567' ' ' ASN . . . . . 0.426 ' N ' HG23 ' B' ' 566' ' ' VAL . 42.0 m-80 -51.07 -37.38 45.23 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 116.002 -0.545 . . . . 1.9399999999999999 112.007 170.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 568' ' ' LYS . . . . . 0.436 ' HD3' HD11 ' A' ' 14' ' ' LEU . 29.8 ttpt -72.64 -32.67 66.06 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.77 -0.456 . . . . 3.5299999999999998 109.77 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 569' ' ' LEU . . . . . 0.717 HD23 ' HA ' ' B' ' 566' ' ' VAL . 0.2 OUTLIER -67.5 -36.49 81.17 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.687 -0.857 . . . . 2.0099999999999998 108.687 177.058 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 570' ' ' PHE . . . . . 0.527 ' HD1' HG13 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.38 -39.27 92.05 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.907 -0.405 . . . . 3.77 109.907 178.346 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -57.74 -53.49 57.61 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.982 -0.687 . . . . 2.4700000000000002 110.47 176.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 572' ' ' PHE . . . . . 0.647 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 22.6 m-85 -62.45 -9.98 10.17 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.118 1.155 . . . . 1.23 114.118 -177.15 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 573' ' ' MET . . . . . 0.48 ' HB3' HD21 ' B' ' 625' ' ' LEU . 35.5 mtt -76.38 -5.26 46.44 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.641 0.734 . . . . 2.1099999999999999 109.651 178.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -109.44 -0.56 18.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.82 -1.082 . . . . 3.2000000000000002 111.411 173.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 575' ' ' GLU . . . . . 0.647 ' HG2' ' HA ' ' B' ' 572' ' ' PHE . 29.4 mm-40 -68.53 130.23 42.25 Favored 'General case' 0 C--O 1.233 0.221 0 O-C-N 123.422 0.451 . . . . 1.55 110.077 177.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 82.7 p -87.84 -21.36 25.07 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 113.011 0.745 . . . . 1.3999999999999999 113.011 -177.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -60.09 128.03 34.81 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.425 0.631 . . . . 2.8500000000000001 112.532 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -44.96 125.84 5.42 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.332 -0.849 . . . . 2.1499999999999999 113.119 -171.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.27 -34.69 4.8 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.219 1.247 . . . . 0.0 116.219 174.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 55.5 t -53.72 -46.42 62.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.13 0.789 . . . . 1.29 113.13 -175.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -59.57 -42.34 92.26 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.406 0.521 . . . . 1.99 112.406 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -60.53 -42.41 96.42 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 112.19 0.441 . . . . 2.23 112.19 172.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 6.9 tpt -60.7 -49.53 77.15 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 121.058 -0.257 . . . . 2.5800000000000001 110.416 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.79 -42.93 80.32 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.181 -0.463 . . . . 0.029999999999999999 111.692 -177.105 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 585' ' ' CYS . . . . . 0.423 ' O ' HG13 ' B' ' 589' ' ' ILE . 52.0 t -74.49 -40.87 61.55 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 119.976 -0.69 . . . . 1.5 111.91 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.54 -46.34 89.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.351 -0.386 . . . . 1.98 111.995 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 86.4 m -62.21 -41.22 98.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.3 110.381 175.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 588' ' ' PHE . . . . . 0.487 ' HB2' HD13 ' B' ' 569' ' ' LEU . 19.2 t80 -61.44 -32.23 72.2 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.089 -0.505 . . . . 0.53000000000000003 111.146 -177.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 589' ' ' ILE . . . . . 0.423 HG13 ' O ' ' B' ' 585' ' ' CYS . 68.8 mt -79.86 -35.99 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.008 0 C-N-CA 116.902 -1.919 . . . . 1.97 109.773 -175.39 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 590' ' ' LYS . . . . . 0.416 ' O ' ' HE3' ' B' ' 594' ' ' LYS . 67.8 mttm -57.47 -50.04 74.32 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 107.717 -1.216 . . . . 2.6200000000000001 107.717 176.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 591' ' ' ILE . . . . . 0.535 HD11 ' HA2' ' B' ' 549' ' ' GLY . 1.7 mp -63.77 -43.74 98.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.693 -0.685 . . . . 1.96 112.815 -177.021 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.95 -39.12 93.41 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.443 -0.503 . . . . 0.0 112.275 177.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -62.37 -70.02 0.22 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 119.096 -1.041 . . . . 2.3599999999999999 109.834 174.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 594' ' ' LYS . . . . . 0.549 ' HG2' ' HG3' ' B' ' 552' ' ' PRO . 0.0 OUTLIER -56.14 -23.8 36.91 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 116.655 2.095 . . . . 2.1899999999999999 116.655 -176.565 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 83.8 m -121.63 25.21 9.42 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.243 1.201 . . . . 1.26 114.243 -178.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -48.59 -38.49 20.9 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.792 1.775 . . . . 3.5800000000000001 115.792 -172.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 597' ' ' ARG . . . . . 0.425 ' O ' ' HG2' ' B' ' 601' ' ' GLN . 38.5 mmt180 -69.52 -32.69 71.69 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.202 0.816 . . . . 3.7400000000000002 113.202 -175.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 598' ' ' HIS . . . . . 0.571 ' HE2' ' HG3' ' B' ' 556' ' ' ARG . 31.3 m80 -70.13 -3.82 18.49 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.662 -0.699 . . . . 2.1400000000000001 112.053 -173.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 599' ' ' PHE . . . . . 0.544 ' O ' HG23 ' B' ' 611' ' ' ILE . 74.8 m-85 -105.52 -16.94 14.57 Favored 'General case' 0 CA--C 1.517 -0.295 0 O-C-N 123.669 0.606 . . . . 2.9500000000000002 110.279 -176.575 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 10.0 p -105.81 -24.36 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.031 -0.986 . . . . 1.4199999999999999 111.311 -175.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 601' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 30.3 pt20 -102.02 139.5 37.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.578 -0.849 . . . . 2.3399999999999999 111.569 176.438 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 6.6 m -60.91 122.71 12.1 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.441 0 N-CA-C 108.599 -0.889 . . . . 1.3700000000000001 108.599 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 603' ' ' GLN . . . . . 0.429 ' HB2' ' HE1' ' B' ' 610' ' ' PHE . 13.7 mm100 -92.78 167.31 11.95 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 123.729 0.643 . . . . 2.6800000000000002 110.048 -177.553 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 62.1 t -71.98 128.99 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 113.018 0.748 . . . . 1.27 113.018 -175.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.4 6.5 64.38 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.039 -175.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -131.5 158.08 41.83 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.651 -0.82 . . . . 2.5099999999999998 110.788 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 607' ' ' VAL . . . . . 0.608 HG23 ' HG2' ' B' ' 608' ' ' MET . 19.0 m -103.29 -22.59 4.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.023 -0.989 . . . . 1.3999999999999999 112.447 -175.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 608' ' ' MET . . . . . 0.608 ' HG2' HG23 ' B' ' 607' ' ' VAL . 94.1 mmm -136.99 142.22 37.62 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 112.649 0.611 . . . . 2.6800000000000002 112.649 -174.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -52.07 130.84 36.65 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 120.899 1.066 . . . . 0.42999999999999999 112.165 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 610' ' ' PHE . . . . . 0.464 ' H ' ' HD1' ' B' ' 610' ' ' PHE . 7.8 m-85 -56.96 -31.8 65.39 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 111.874 0.324 . . . . 2.3700000000000001 111.874 -174.102 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 611' ' ' ILE . . . . . 0.544 HG23 ' O ' ' B' ' 599' ' ' PHE . 10.3 pt -50.07 -44.79 22.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-O 120.726 0.298 . . . . 1.8400000000000001 110.548 178.173 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -50.01 -52.02 37.3 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.597 0.759 . . . . 2.1499999999999999 112.821 177.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -59.96 -37.05 78.47 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.535 -0.466 . . . . 2.6600000000000001 110.234 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 614' ' ' ILE . . . . . 0.412 HD12 ' HA ' ' B' ' 611' ' ' ILE . 60.5 mt -64.44 -48.1 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 120.246 -0.582 . . . . 1.76 111.925 178.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 55.0 tp -62.61 -31.17 71.96 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.955 0.724 . . . . 1.8400000000000001 112.955 -177.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -79.5 2.12 23.23 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.621 1.341 . . . . 2.0600000000000001 114.621 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 617' ' ' ASN . . . . . 0.434 ' O ' HG22 ' B' ' 621' ' ' ILE . 38.8 m-80 -142.44 15.67 2.01 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.168 0.803 . . . . 1.97 113.168 -174.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 618' ' ' ILE . . . . . 0.466 HG13 ' N ' ' B' ' 619' ' ' ASN . 20.9 pt -46.92 -47.06 8.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 C-N-CA 118.957 -1.097 . . . . 2.0099999999999998 110.127 -176.647 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 619' ' ' ASN . . . . . 0.466 ' N ' HG13 ' B' ' 618' ' ' ILE . 18.8 m120 -63.2 -51.05 67.89 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.787 1.032 . . . . 2.2799999999999998 113.787 -176.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 42.0 m -56.92 -31.83 65.33 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 119.455 -0.898 . . . . 1.3200000000000001 110.763 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 621' ' ' ILE . . . . . 0.527 HG13 ' HD1' ' B' ' 570' ' ' PHE . 15.0 tt -79.35 -42.61 23.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 115.355 1.613 . . . . 2.0 115.355 -179.021 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 622' ' ' ILE . . . . . 0.452 HG23 HG23 ' B' ' 621' ' ' ILE . 38.3 pt -87.73 -6.24 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 115.09 1.515 . . . . 2.0899999999999999 115.09 -177.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.7 t -19.9 -58.39 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 116.598 2.073 . . . . 1.47 116.598 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -99.21 -7.56 26.33 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 113.981 -1.463 . . . . 2.0699999999999998 111.056 -164.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 625' ' ' LEU . . . . . 0.48 HD21 ' HB3' ' B' ' 573' ' ' MET . 90.2 mt -71.9 146.91 47.54 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.264 0.352 . . . . 1.6699999999999999 111.654 -173.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 626' ' ' GLN . . . . . 0.451 ' O ' HG23 ' B' ' 630' ' ' VAL . 30.0 mm-40 -76.84 162.09 71.51 Favored Pre-proline 0 CA--C 1.519 -0.233 0 N-CA-C 108.773 -0.825 . . . . 2.3500000000000001 108.773 174.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -47.83 -43.61 28.88 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.813 1.428 . . . . 0.44 115.813 -178.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 21.7 tm0? -67.25 -43.01 82.97 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 120.423 -0.511 . . . . 2.6200000000000001 109.686 -174.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -63.35 -38.16 90.07 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.856 -0.611 . . . . 2.0600000000000001 110.904 178.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 630' ' ' VAL . . . . . 0.451 HG23 ' O ' ' B' ' 626' ' ' GLN . 67.2 t . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.33 -0.843 . . . . 1.3 110.687 176.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.187 0 N-CA-C 112.558 -0.217 . . . . 9.8599999999999994 112.558 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.8 t -151.91 79.65 1.26 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.84 0.352 . . . . 8.7799999999999994 110.749 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.78 -22.45 46.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 6.8200000000000003 111.126 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 84.2 p -149.94 -26.81 0.25 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.109 -0.496 . . . . 6.25 110.827 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 112.29 177.44 19.92 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.763 -0.732 . . . . 4.1200000000000001 112.657 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -139.58 -11.86 1.17 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.88 0.371 . . . . 4.0300000000000002 110.849 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.412 ' N ' HD12 ' A' ' 7' ' ' LEU . 7.7 mp -77.98 -9.29 59.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.057 -0.52 . . . . 2.21 110.975 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -60.73 -26.79 67.44 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.299 -0.41 . . . . 3.79 111.179 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -78.55 -47.65 16.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.264 -0.425 . . . . 4.1699999999999999 110.94 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.602 HD22 HG21 ' B' ' 518' ' ' VAL . 1.8 pp -73.94 -9.04 58.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 2.5800000000000001 111.068 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.49 -16.14 60.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.953 0.406 . . . . 2.8399999999999999 110.803 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 43.1 tp -70.84 -9.49 57.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.982 -0.554 . . . . 3.6699999999999999 110.764 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.404 ' HB3' ' CD2' ' B' ' 525' ' ' LEU . 14.2 mptt -66.37 -50.53 63.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.043 -0.526 . . . . 4.9299999999999997 111.997 -179.433 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.13 -8.59 46.8 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.625 0.25 . . . . 3.27 111.362 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.09 -20.89 0.39 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.079 0.4 . . . . 3.1299999999999999 112.079 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -152.32 136.34 5.38 Favored Glycine 0 C--N 1.332 0.359 0 C-N-CA 120.315 -0.945 . . . . 2.4700000000000002 113.195 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.492 HD11 ' SG ' ' B' ' 528' ' ' CYS . 22.0 tp -137.62 157.62 46.11 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 110.263 -0.273 . . . . 2.1400000000000001 110.263 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -117.04 105.43 12.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.769 0.319 . . . . 3.9199999999999999 111.023 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 6.4 tp -130.36 -33.5 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.193 -0.458 . . . . 3.25 110.947 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -81.33 -57.83 3.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.14 -0.482 . . . . 5.9500000000000002 111.157 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.473 ' HG2' HG23 ' A' ' 22' ' ' THR . 87.5 tttt -169.08 -55.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.227 -0.442 . . . . 9.3900000000000006 110.699 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.473 HG23 ' HG2' ' A' ' 21' ' ' LYS . 81.6 p -129.63 173.58 10.48 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.131 -0.486 . . . . 8.9700000000000006 110.998 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -96.11 -72.66 0.62 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.442 -0.345 . . . . 11.67 110.782 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 140.87 -115.82 1.07 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.743 -0.742 . . . . 12.859999999999999 112.595 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -139.98 142.45 36.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.774 0.321 . . . . 15.369999999999999 110.888 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -83.61 122.69 28.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.264 -0.425 . . . . 16.539999999999999 111.265 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.4 t . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.203 -0.903 . . . . 17.93 111.296 179.901 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 35.0 pt . . . . . 0 C--O 1.235 0.291 0 N-CA-C 113.06 0.763 . . . . 2.1299999999999999 113.06 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 42.3 t -49.01 119.21 3.06 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.545 0.572 . . . . 1.29 112.545 174.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.79 1.5 67.87 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.995 -0.621 . . . . 0.0 114.418 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.31 -7.53 41.59 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.711 0.755 . . . . 0.02 112.443 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 508' ' ' MET . . . . . 0.426 ' HB2' ' HG2' ' B' ' 513' ' ' GLU . 24.6 mmt -112.46 159.96 18.23 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 121.123 0.487 . . . . 2.21 112.297 174.126 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -69.78 134.19 48.29 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.119 -0.697 . . . . 2.6699999999999999 109.119 174.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -41.67 -35.4 0.76 Allowed 'General case' 0 C--O 1.24 0.567 0 N-CA-C 113.401 0.889 . . . . 2.6600000000000001 113.401 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -73.74 -41.91 61.87 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.505 -0.771 . . . . 2.4399999999999999 112.17 -176.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -64.9 -40.18 94.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.16 0.505 . . . . 2.0800000000000001 110.831 171.224 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 513' ' ' GLU . . . . . 0.426 ' HG2' ' HB2' ' B' ' 508' ' ' MET . 43.2 mt-10 -53.61 -48.76 68.98 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.357 -0.838 . . . . 1.9199999999999999 111.084 177.35 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -54.76 -57.66 10.66 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 111.917 0.34 . . . . 2.73 111.917 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 515' ' ' ARG . . . . . 0.523 ' O ' HG12 ' B' ' 518' ' ' VAL . 39.5 ttm180 -56.6 -35.93 68.83 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.132 0.895 . . . . 3.75 111.086 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.48 ' O ' HG23 ' B' ' 520' ' ' VAL . 56.7 t80 -76.14 -45.6 32.8 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.104 -0.953 . . . . 1.8899999999999999 110.504 -173.337 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 517' ' ' LEU . . . . . 0.491 ' O ' HG12 ' B' ' 521' ' ' ILE . 93.6 mt -66.72 -32.1 73.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.685 -0.689 . . . . 1.8999999999999999 112.752 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 518' ' ' VAL . . . . . 0.602 HG21 HD22 ' A' ' 10' ' ' LEU . 12.6 p -67.6 -35.03 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 118.456 -1.297 . . . . 1.3999999999999999 109.075 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 40.6 p -73.01 -36.3 66.98 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.1799999999999999 112.391 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 520' ' ' VAL . . . . . 0.48 HG23 ' O ' ' B' ' 516' ' ' PHE . 51.1 t -71.29 -42.22 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.416 -0.356 . . . . 1.22 111.716 -174.42 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 521' ' ' ILE . . . . . 0.491 HG12 ' O ' ' B' ' 517' ' ' LEU . 18.6 pt -90.78 -25.68 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 115.391 1.626 . . . . 1.98 115.391 -175.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 26.6 ttpp -60.91 -35.12 75.86 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.681 -0.859 . . . . 2.5699999999999998 108.681 173.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -92.43 -21.52 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.991 1.478 . . . . 2.1699999999999999 114.991 -177.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 524' ' ' LEU . . . . . 0.55 ' HG ' HD11 ' B' ' 540' ' ' ILE . 4.6 mp -70.63 -45.43 65.21 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.28 -0.637 . . . . 1.48 109.28 169.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 525' ' ' LEU . . . . . 0.404 ' CD2' ' HB3' ' A' ' 13' ' ' LYS . 26.9 tp -52.15 -45.56 65.07 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.253 0.549 . . . . 1.95 110.953 169.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.43 -40.52 94.47 Favored Glycine 0 N--CA 1.445 -0.735 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 527' ' ' LEU . . . . . 0.481 HD23 HD13 ' B' ' 540' ' ' ILE . 39.6 tp -63.55 -36.12 82.73 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.035 0.445 . . . . 1.6699999999999999 111.402 175.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 528' ' ' CYS . . . . . 0.492 ' SG ' HD11 ' A' ' 17' ' ' LEU . 41.8 t -63.49 -47.81 80.22 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 116.065 -0.516 . . . . 0.58999999999999997 110.632 -175.228 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -61.73 -29.5 70.16 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.467 -0.788 . . . . 2.5 112.615 173.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -71.7 -54.76 9.27 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.336 0.865 . . . . 2.2400000000000002 113.336 -177.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.73 137.95 54.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.014 -0.539 . . . . 2.2799999999999998 111.099 -177.447 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 11.1 ptp180 -96.5 160.71 14.25 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.83 -0.623 . . . . 4.21 110.117 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.62 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.854 -0.612 . . . . 0.0 114.022 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -47.14 -36.58 8.64 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.207 0.817 . . . . 2.9500000000000002 113.207 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -50.59 -51.77 45.29 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 120.373 -0.531 . . . . 2.2000000000000002 110.846 174.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -66.14 -44.84 83.01 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.59 0.589 . . . . 1.47 112.59 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 537' ' ' LYS . . . . . 0.57 ' HA ' HG22 ' B' ' 540' ' ' ILE . 60.3 mttm -67.84 -32.0 72.22 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.263 -174.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.12 -46.91 69.58 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 115.832 -0.622 . . . . 0.040000000000000001 111.137 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 78.8 mt -58.25 -54.91 26.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 1.8200000000000001 111.247 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 540' ' ' ILE . . . . . 0.57 HG22 ' HA ' ' B' ' 537' ' ' LYS . 10.6 tp -56.73 -48.16 81.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.601 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 541' ' ' ALA . . . . . 0.467 ' O ' HG22 ' B' ' 544' ' ' ILE . . . -57.47 -44.04 84.52 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.573 0.953 . . . . 0.02 113.573 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 542' ' ' SER . . . . . 0.565 ' O ' ' HG2' ' B' ' 545' ' ' MET . 94.7 p -60.47 -38.74 85.21 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.574 -0.45 . . . . 1.2 110.296 -178.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 543' ' ' ASN . . . . . 0.468 ' O ' HD13 ' B' ' 547' ' ' ILE . 75.9 m-20 -69.03 -47.14 66.16 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.316 1.228 . . . . 2.0299999999999998 114.316 -175.238 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 544' ' ' ILE . . . . . 0.467 HG22 ' O ' ' B' ' 541' ' ' ALA . 14.7 tt -52.64 -46.0 48.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.46 -0.941 . . . . 1.8100000000000001 108.46 170.061 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 545' ' ' MET . . . . . 0.565 ' HG2' ' O ' ' B' ' 542' ' ' SER . 0.0 OUTLIER -64.04 -42.31 97.1 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.688 -0.805 . . . . 2.6000000000000001 112.757 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -58.34 -48.76 79.52 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 119.213 -0.995 . . . . 2.0800000000000001 109.867 176.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 547' ' ' ILE . . . . . 0.468 HD13 ' O ' ' B' ' 543' ' ' ASN . 1.7 mp -55.09 -61.38 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.854 0.687 . . . . 1.5 112.854 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 548' ' ' VAL . . . . . 0.618 HG22 HD11 ' B' ' 555' ' ' LEU . 9.9 p -47.29 -44.32 8.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.843 -0.743 . . . . 1.3999999999999999 111.43 176.193 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.02 58.81 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.764 -0.585 . . . . 0.0 112.934 -177.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 550' ' ' GLN . . . . . 0.467 ' C ' ' HD3' ' B' ' 552' ' ' PRO . 32.5 tt0 -87.06 -9.52 55.24 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.617 0.599 . . . . 2.27 112.617 -175.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -120.44 59.64 7.08 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 113.823 1.046 . . . . 3.5299999999999998 113.823 -176.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 552' ' ' PRO . . . . . 0.586 ' HG2' ' HG2' ' B' ' 594' ' ' LYS . 44.2 Cg_exo -55.96 -39.4 91.41 Favored 'Trans proline' 0 C--O 1.222 -0.291 0 O-C-N 122.124 0.539 . . . . 0.46000000000000002 113.151 177.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 553' ' ' ARG . . . . . 0.488 ' HA ' ' HE ' ' B' ' 556' ' ' ARG . 98.9 mtt180 -56.27 -46.68 79.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.164 0.507 . . . . 3.8700000000000001 109.99 -174.201 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.04 -59.7 3.4 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 123.931 0.892 . . . . 0.69999999999999996 112.108 167.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 555' ' ' LEU . . . . . 0.621 ' HB3' HD13 ' B' ' 562' ' ' LEU . 87.0 mt -54.4 -48.51 71.48 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 116.322 -0.399 . . . . 1.49 110.177 -178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 556' ' ' ARG . . . . . 0.488 ' HE ' ' HA ' ' B' ' 553' ' ' ARG . 59.5 mtm180 -53.93 -35.87 62.16 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.827 1.047 . . . . 3.0899999999999999 113.827 -178.313 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.03 -12.26 50.73 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.528 -0.469 . . . . 0.0 112.078 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 558' ' ' HIS . . . . . 0.577 ' ND1' ' HB2' ' B' ' 561' ' ' PHE . 8.5 t-160 -128.22 78.48 1.84 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.405 1.261 . . . . 2.9300000000000002 114.405 -177.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 34.6 p90 -50.48 -48.29 56.8 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 116.526 2.047 . . . . 3.1099999999999999 116.526 -176.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 560' ' ' LYS . . . . . 0.418 ' O ' HG23 ' B' ' 564' ' ' THR . 5.0 tppp? -56.71 -36.55 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.303 -0.408 . . . . 3.3199999999999998 111.15 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 561' ' ' PHE . . . . . 0.577 ' HB2' ' ND1' ' B' ' 558' ' ' HIS . 9.0 t80 -74.96 -45.06 44.86 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 119.1 -1.04 . . . . 1.25 111.908 175.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 562' ' ' LEU . . . . . 0.621 HD13 ' HB3' ' B' ' 555' ' ' LEU . 62.3 tp -49.97 -59.22 4.09 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.515 0.326 . . . . 1.3200000000000001 110.255 175.031 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 563' ' ' LYS . . . . . 0.511 ' O ' HG12 ' B' ' 566' ' ' VAL . 39.7 ttmt -50.16 -38.66 40.54 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.893 1.071 . . . . 2.7400000000000002 113.893 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 564' ' ' THR . . . . . 0.418 HG23 ' O ' ' B' ' 560' ' ' LYS . 23.5 p -71.71 -39.42 70.17 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.572 0.701 . . . . 1.24 110.412 -176.131 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 565' ' ' VAL . . . . . 0.467 HG23 ' O ' ' B' ' 561' ' ' PHE . 85.1 t -62.84 -41.34 92.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.646 -0.706 . . . . 1.1899999999999999 112.527 173.391 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 566' ' ' VAL . . . . . 0.511 HG12 ' O ' ' B' ' 563' ' ' LYS . 13.1 p -70.96 -50.85 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.537 -0.465 . . . . 1.3600000000000001 110.875 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 567' ' ' ASN . . . . . 0.437 ' N ' HG13 ' B' ' 566' ' ' VAL . 42.7 t30 -51.04 -37.47 45.55 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.009 -0.541 . . . . 1.9399999999999999 112.044 170.508 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -72.69 -32.63 65.93 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.716 -0.475 . . . . 3.5299999999999998 109.716 -179.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 569' ' ' LEU . . . . . 0.489 ' O ' ' HG3' ' B' ' 573' ' ' MET . 60.1 mt -67.5 -36.41 81.02 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 108.696 -0.853 . . . . 2.0099999999999998 108.696 177.045 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 570' ' ' PHE . . . . . 0.41 ' CE2' HG22 ' B' ' 566' ' ' VAL . 25.2 m-85 -65.35 -39.38 92.28 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.868 -0.419 . . . . 3.77 109.868 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -57.7 -53.51 57.38 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 119.985 -0.686 . . . . 2.4700000000000002 110.495 176.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 572' ' ' PHE . . . . . 0.631 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 18.6 m-85 -62.44 -9.86 9.79 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.093 1.146 . . . . 1.23 114.093 -177.189 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 573' ' ' MET . . . . . 0.906 ' HB3' HD11 ' B' ' 625' ' ' LEU . 67.9 mtt -76.47 -5.26 46.7 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.637 0.732 . . . . 2.1099999999999999 109.662 178.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -109.49 -0.57 18.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.765 -1.107 . . . . 3.2000000000000002 111.492 173.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 575' ' ' GLU . . . . . 0.631 ' HG2' ' HA ' ' B' ' 572' ' ' PHE . 25.2 mm-40 -68.47 130.15 42.01 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.169 -0.469 . . . . 1.55 110.214 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 76.8 p -87.79 -21.41 25.12 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.941 0.719 . . . . 1.3999999999999999 112.941 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -60.1 128.05 34.9 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.418 0.627 . . . . 2.8500000000000001 112.584 -175.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -44.95 125.88 5.44 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.372 -0.831 . . . . 2.1499999999999999 113.103 -171.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 579' ' ' GLY . . . . . 0.415 ' O ' ' HG2' ' B' ' 583' ' ' MET . . . 96.23 -34.74 4.76 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.195 1.238 . . . . 0.0 116.195 174.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 47.1 t -53.77 -46.22 62.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.173 0.805 . . . . 1.29 113.173 -175.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -59.75 -42.27 92.87 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.333 0.494 . . . . 1.99 112.333 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -60.53 -42.46 96.55 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 112.202 0.445 . . . . 2.23 112.202 172.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 583' ' ' MET . . . . . 0.556 ' HB3' ' SD ' ' B' ' 545' ' ' MET . 28.6 mmt -60.66 -49.47 77.37 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.99 -0.284 . . . . 2.5800000000000001 110.475 175.508 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.97 80.32 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.197 -0.456 . . . . 0.029999999999999999 111.722 -177.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 77.5 m -74.32 -41.02 61.82 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 120.078 -0.649 . . . . 1.5 111.949 -177.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 586' ' ' ASP . . . . . 0.651 ' O ' HG22 ' B' ' 589' ' ' ILE . 69.2 m-20 -59.56 -46.3 89.3 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 116.252 -0.431 . . . . 1.98 111.984 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 587' ' ' THR . . . . . 0.413 ' OG1' ' HG3' ' B' ' 545' ' ' MET . 73.7 m -62.19 -41.22 98.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.3 110.43 175.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -61.45 -32.23 72.2 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.085 -0.507 . . . . 0.53000000000000003 111.177 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 589' ' ' ILE . . . . . 0.651 HG22 ' O ' ' B' ' 586' ' ' ASP . 10.0 tp -79.88 -35.95 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.835 -1.946 . . . . 1.97 109.74 -175.363 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 590' ' ' LYS . . . . . 0.429 ' O ' ' HE3' ' B' ' 594' ' ' LYS . 67.1 mttm -57.51 -50.02 74.44 Favored 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 107.697 -1.223 . . . . 2.6200000000000001 107.697 176.151 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 74.6 mt -63.76 -43.85 98.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 123.345 0.658 . . . . 1.96 112.77 -177.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.08 93.37 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.417 -0.513 . . . . 0.0 112.331 177.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -62.35 -70.14 0.22 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 119.12 -1.032 . . . . 2.3599999999999999 109.783 174.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 594' ' ' LYS . . . . . 0.586 ' HG2' ' HG2' ' B' ' 552' ' ' PRO . 0.0 OUTLIER -56.02 -23.79 35.27 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 116.69 2.107 . . . . 2.1899999999999999 116.69 -176.564 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 74.3 m -121.74 25.26 9.34 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.249 1.203 . . . . 1.26 114.249 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 596' ' ' ARG . . . . . 0.521 ' HG3' ' HD3' ' B' ' 597' ' ' ARG . 24.3 ptt180 -48.48 -38.54 20.32 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.856 1.799 . . . . 3.5800000000000001 115.856 -172.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 597' ' ' ARG . . . . . 0.521 ' HD3' ' HG3' ' B' ' 596' ' ' ARG . 0.5 OUTLIER -69.66 -32.53 71.24 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.225 0.824 . . . . 3.7400000000000002 113.225 -175.512 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 51.8 m-70 -70.09 -3.86 18.54 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-N 115.581 -0.736 . . . . 2.1400000000000001 112.054 -173.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -105.55 -16.93 14.57 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.613 0.571 . . . . 2.9500000000000002 110.18 -176.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 600' ' ' VAL . . . . . 0.414 HG22 ' O ' ' B' ' 597' ' ' ARG . 33.8 m -105.82 -24.41 4.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 CA-C-N 115.114 -0.948 . . . . 1.4199999999999999 111.242 -175.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 601' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 13.9 pt20 -101.95 139.49 37.51 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.56 -0.856 . . . . 2.3399999999999999 111.635 176.38 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 48.9 t -60.89 122.66 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 108.596 -0.89 . . . . 1.3700000000000001 108.596 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -92.67 167.3 11.99 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.649 0.593 . . . . 2.6800000000000002 110.138 -177.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 40.5 t -71.99 129.03 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 119.87 -0.732 . . . . 1.27 112.968 -175.233 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.31 6.6 64.45 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.096 -175.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 606' ' ' GLU . . . . . 0.505 ' HG3' ' H ' ' B' ' 608' ' ' MET . 10.5 tp10 -131.46 157.98 42.05 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.667 -0.813 . . . . 2.5099999999999998 110.841 175.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 33.9 m -103.24 -22.53 4.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.063 -0.972 . . . . 1.3999999999999999 112.507 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 608' ' ' MET . . . . . 0.505 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 52.6 ttm -136.97 142.18 37.5 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.651 0.611 . . . . 2.6800000000000002 112.651 -174.2 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 609' ' ' PRO . . . . . 0.499 ' HD2' ' HG3' ' B' ' 608' ' ' MET . 54.2 Cg_exo -52.11 130.96 37.28 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.89 1.06 . . . . 0.42999999999999999 112.086 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -57.03 -31.86 65.58 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 123.183 0.302 . . . . 2.3700000000000001 111.799 -174.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 611' ' ' ILE . . . . . 0.42 HG23 ' N ' ' B' ' 612' ' ' ASP . 13.4 tt -49.92 -44.97 21.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 120.816 0.341 . . . . 1.8400000000000001 110.538 178.207 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 612' ' ' ASP . . . . . 0.42 ' N ' HG23 ' B' ' 611' ' ' ILE . 15.0 m-20 -49.86 -52.0 36.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.612 0.765 . . . . 2.1499999999999999 112.875 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.02 -37.06 78.64 Favored 'General case' 0 C--O 1.244 0.802 0 C-N-CA 120.555 -0.458 . . . . 2.6600000000000001 110.183 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 72.6 mt -64.53 -47.93 87.1 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 120.214 -0.594 . . . . 1.76 112.002 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 93.3 mt -62.67 -31.17 72.0 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.955 0.724 . . . . 1.8400000000000001 112.955 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -79.5 2.12 23.23 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.621 1.341 . . . . 2.0600000000000001 114.621 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 617' ' ' ASN . . . . . 0.574 ' HB2' HG22 ' B' ' 620' ' ' THR . 26.2 p30 -142.44 15.62 2.01 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.168 0.803 . . . . 1.97 113.168 -174.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 618' ' ' ILE . . . . . 0.496 HG13 ' N ' ' B' ' 619' ' ' ASN . 16.7 pt -46.9 -47.02 8.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.0099999999999998 110.222 -176.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 619' ' ' ASN . . . . . 0.496 ' N ' HG13 ' B' ' 618' ' ' ILE . 7.3 t30 -63.12 -51.21 67.44 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 113.777 1.028 . . . . 2.2799999999999998 113.777 -176.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 620' ' ' THR . . . . . 0.574 HG22 ' HB2' ' B' ' 617' ' ' ASN . 4.1 t -56.82 -31.87 65.16 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 119.445 -0.902 . . . . 1.3200000000000001 110.785 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 621' ' ' ILE . . . . . 0.521 HG13 HG23 ' B' ' 622' ' ' ILE . 36.1 pt -79.26 -42.73 23.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 115.342 1.608 . . . . 2.0 115.342 -179.036 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 622' ' ' ILE . . . . . 0.737 ' HA ' HD13 ' B' ' 625' ' ' LEU . 39.5 pt -87.67 -6.32 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 115.031 1.493 . . . . 2.0899999999999999 115.031 -177.617 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.3 t -19.9 -58.33 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 116.642 2.09 . . . . 1.47 116.642 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -99.35 -7.53 26.11 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.028 -1.442 . . . . 2.0699999999999998 110.973 -163.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 625' ' ' LEU . . . . . 0.906 HD11 ' HB3' ' B' ' 573' ' ' MET . 9.5 mp -71.81 146.85 47.75 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.493 -0.321 . . . . 1.6699999999999999 111.748 -173.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 626' ' ' GLN . . . . . 0.422 ' O ' HG23 ' B' ' 630' ' ' VAL . 96.7 mt-30 -76.73 162.09 71.69 Favored Pre-proline 0 N--CA 1.464 0.237 0 N-CA-C 108.843 -0.799 . . . . 2.3500000000000001 108.843 174.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -47.81 -43.6 28.82 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.823 1.432 . . . . 0.44 115.823 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -67.33 -43.0 82.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.427 -0.509 . . . . 2.6200000000000001 109.631 -174.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -63.31 -38.2 90.22 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.924 -0.58 . . . . 2.0600000000000001 110.924 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 630' ' ' VAL . . . . . 0.422 HG23 ' O ' ' B' ' 626' ' ' GLN . 90.7 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.195 -0.907 . . . . 1.3 110.615 176.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.18 0 N-CA-C 112.399 -0.28 . . . . 9.8599999999999994 112.399 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.1 m -91.47 138.23 31.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.784 0.326 . . . . 8.7799999999999994 110.807 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.53 -176.83 0.12 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.08 -0.509 . . . . 6.8200000000000003 111.267 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.2 m -153.54 25.9 0.51 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.992 -0.549 . . . . 6.25 110.732 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 167.95 159.22 13.13 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.784 -0.722 . . . . 4.1200000000000001 112.348 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -141.63 -22.8 0.73 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.728 0.299 . . . . 4.0300000000000002 111.004 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.539 HD12 HD22 ' A' ' 10' ' ' LEU . 20.3 tp -76.18 -18.22 59.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.284 -0.417 . . . . 2.21 110.905 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -76.74 -50.28 13.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.919 0.39 . . . . 3.79 110.801 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -76.13 -9.85 58.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.098 -0.501 . . . . 4.1699999999999999 110.351 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.539 HD22 HD12 ' A' ' 7' ' ' LEU . 13.5 tp -62.95 -38.32 90.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.695 -0.684 . . . . 2.5800000000000001 111.022 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.07 -10.33 59.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.138 -0.483 . . . . 2.8399999999999999 111.519 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 24.9 tp -60.62 -22.91 64.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.345 -0.388 . . . . 3.6699999999999999 110.943 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -80.39 -21.65 42.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.248 -0.433 . . . . 4.9299999999999997 111.71 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.663 HD13 ' O ' ' A' ' 14' ' ' LEU . 2.2 tm? -51.96 -29.4 20.33 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.885 0.374 . . . . 3.27 110.505 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.24 -17.93 0.3 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.012 -0.54 . . . . 3.1299999999999999 111.949 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -84.02 -122.78 0.96 Allowed Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.83 -0.7 . . . . 2.4700000000000002 112.44 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.447 HD23 HD12 ' B' ' 525' ' ' LEU . 0.3 OUTLIER 55.54 83.41 0.09 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.773 0.32 . . . . 2.1400000000000001 110.716 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -95.73 153.31 17.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 3.9199999999999999 110.924 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 18.1 tt -171.78 -18.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 3.25 110.887 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -65.56 94.63 0.19 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.214 -0.448 . . . . 5.9500000000000002 110.763 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.8 ptmm? -165.38 137.83 4.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.404 -0.362 . . . . 9.3900000000000006 111.136 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.0 p -116.63 -49.14 2.66 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.119 -0.491 . . . . 8.9700000000000006 111.015 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 57.59 90.17 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.17 -0.468 . . . . 11.67 111.05 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 158.18 -93.71 0.13 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.873 -0.68 . . . . 12.859999999999999 112.425 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 54.75 77.48 0.2 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.794 0.33 . . . . 15.369999999999999 111.027 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -132.17 28.75 4.4 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.179 -0.464 . . . . 16.539999999999999 110.868 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 52.1 t . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.191 -0.909 . . . . 17.93 111.081 -179.954 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 504' ' ' ILE . . . . . 0.432 ' N ' HD13 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.339 0 N-CA-C 113.069 0.766 . . . . 2.1299999999999999 113.069 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 79.2 p -48.83 119.13 2.95 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.542 0.571 . . . . 1.29 112.542 174.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.82 1.43 67.85 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 120.926 -0.654 . . . . 0.0 114.477 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.53 41.5 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.627 0.714 . . . . 0.02 112.443 176.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 63.2 mtt -112.47 159.99 18.22 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.11 0.481 . . . . 2.21 112.221 174.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -69.79 134.25 48.34 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.061 -0.718 . . . . 2.6699999999999999 109.061 174.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -41.62 -35.48 0.76 Allowed 'General case' 0 C--O 1.241 0.623 0 N-CA-C 113.39 0.885 . . . . 2.6600000000000001 113.39 -173.283 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -73.8 -41.92 61.69 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.541 -0.754 . . . . 2.4399999999999999 112.087 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -64.88 -40.1 94.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.111 0.482 . . . . 2.0800000000000001 110.863 171.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -53.64 -48.71 69.12 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.38 -0.827 . . . . 1.9199999999999999 111.141 177.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 514' ' ' LYS . . . . . 0.541 ' O ' HG13 ' B' ' 518' ' ' VAL . 39.0 ttmt -54.88 -57.56 11.11 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 111.93 0.345 . . . . 2.73 111.93 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 515' ' ' ARG . . . . . 0.523 ' O ' HG22 ' B' ' 518' ' ' VAL . 28.2 mmm180 -56.62 -35.94 68.89 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 124.221 0.951 . . . . 3.75 111.124 -177.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.718 ' O ' HG13 ' B' ' 520' ' ' VAL . 70.8 t80 -76.08 -45.58 33.34 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.101 -0.954 . . . . 1.8899999999999999 110.515 -173.37 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 517' ' ' LEU . . . . . 0.748 ' HA ' HG22 ' B' ' 520' ' ' VAL . 3.1 tt -66.76 -32.24 73.41 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.755 -0.657 . . . . 1.8999999999999999 112.606 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 518' ' ' VAL . . . . . 0.541 HG13 ' O ' ' B' ' 514' ' ' LYS . 34.2 m -67.53 -35.07 72.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 118.473 -1.291 . . . . 1.3999999999999999 109.087 178.544 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 47.8 m -72.96 -36.35 67.13 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.295 0.569 . . . . 1.1799999999999999 112.437 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 520' ' ' VAL . . . . . 0.748 HG22 ' HA ' ' B' ' 517' ' ' LEU . 22.0 m -71.23 -42.35 74.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.418 -0.355 . . . . 1.22 111.643 -174.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 521' ' ' ILE . . . . . 0.701 HG23 HG23 ' B' ' 520' ' ' VAL . 30.5 pt -90.64 -25.75 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 115.487 1.662 . . . . 1.98 115.487 -175.146 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.88 -35.24 76.12 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.694 -0.854 . . . . 2.5699999999999998 108.694 173.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 523' ' ' ASP . . . . . 0.404 ' O ' ' HG ' ' B' ' 527' ' ' LEU . 18.5 t70 -92.36 -21.49 20.21 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.037 1.495 . . . . 2.1699999999999999 115.037 -177.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 524' ' ' LEU . . . . . 0.494 HD13 ' O ' ' B' ' 520' ' ' VAL . 5.2 mp -70.61 -45.33 65.46 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.305 -0.628 . . . . 1.48 109.305 168.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 525' ' ' LEU . . . . . 0.447 HD12 HD23 ' A' ' 17' ' ' LEU . 44.5 tp -52.31 -45.46 65.57 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 121.236 0.541 . . . . 1.95 110.91 169.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 526' ' ' GLY . . . . . 0.458 ' O ' ' HG2' ' B' ' 529' ' ' GLU . . . -66.5 -40.56 94.33 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -178.539 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 527' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' B' ' 523' ' ' ASP . 74.6 mt -63.57 -36.12 82.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 1.6699999999999999 111.47 175.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 42.4 t -63.5 -47.77 80.36 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.041 -0.527 . . . . 0.58999999999999997 110.634 -175.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 529' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' B' ' 526' ' ' GLY . 10.9 pt-20 -61.58 -29.71 70.2 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.544 -0.753 . . . . 2.5 112.542 173.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -71.62 -54.74 9.43 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.375 0.88 . . . . 2.2400000000000002 113.375 -177.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -68.76 137.95 54.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.0 -0.545 . . . . 2.2799999999999998 111.07 -177.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 532' ' ' ARG . . . . . 0.405 ' HG2' ' N ' ' B' ' 533' ' ' GLY . 68.2 ttt180 -96.46 160.6 14.32 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.813 -0.631 . . . . 4.21 110.16 178.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 533' ' ' GLY . . . . . 0.405 ' N ' ' HG2' ' B' ' 532' ' ' ARG . . . 87.53 119.56 1.37 Allowed Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 115.848 -0.614 . . . . 0.0 114.007 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -47.08 -36.63 8.42 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.241 0.83 . . . . 2.9500000000000002 113.241 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -50.52 -51.92 43.3 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 120.33 -0.548 . . . . 2.2000000000000002 110.851 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 536' ' ' ASN . . . . . 0.498 ' O ' HG22 ' B' ' 539' ' ' ILE . 18.7 m120 -65.95 -44.87 83.74 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.717 0.636 . . . . 1.47 112.717 178.271 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 537' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -67.76 -32.04 72.36 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.408 -0.517 . . . . 2.5 110.283 -174.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.13 -46.92 69.5 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.896 -0.593 . . . . 0.040000000000000001 111.112 178.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 539' ' ' ILE . . . . . 0.498 HG22 ' O ' ' B' ' 536' ' ' ASN . 0.4 OUTLIER -58.19 -54.92 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.56 0.695 . . . . 1.8200000000000001 111.307 173.42 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 540' ' ' ILE . . . . . 0.494 ' N ' ' CG2' ' B' ' 539' ' ' ILE . 82.4 mt -56.77 -48.18 81.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.566 -178.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.38 -44.05 84.1 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 113.68 0.993 . . . . 0.02 113.68 179.349 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 63.4 m -60.43 -38.76 85.11 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.619 -0.432 . . . . 1.2 110.351 -178.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 543' ' ' ASN . . . . . 0.434 ' O ' HG12 ' B' ' 547' ' ' ILE . 42.1 t30 -69.0 -47.14 66.23 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.316 1.228 . . . . 2.0299999999999998 114.316 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 544' ' ' ILE . . . . . 0.402 HG12 ' HB3' ' B' ' 524' ' ' LEU . 57.6 mt -52.64 -45.96 48.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.471 -0.937 . . . . 1.8100000000000001 108.471 170.076 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 545' ' ' MET . . . . . 0.762 ' HB3' HG21 ' B' ' 587' ' ' THR . 50.6 mtp -64.05 -42.24 97.11 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 119.718 -0.793 . . . . 2.6000000000000001 112.828 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -58.37 -48.8 79.42 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 119.272 -0.971 . . . . 2.0800000000000001 109.829 176.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 547' ' ' ILE . . . . . 0.517 ' O ' ' HG2' ' B' ' 550' ' ' GLN . 43.2 mm -55.06 -61.36 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.854 0.687 . . . . 1.5 112.854 179.173 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 548' ' ' VAL . . . . . 0.617 HG22 HD11 ' B' ' 555' ' ' LEU . 12.4 p -47.41 -44.23 9.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 C-N-CA 119.892 -0.723 . . . . 1.3999999999999999 111.388 176.262 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.32 -28.1 58.68 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.799 -0.563 . . . . 0.0 112.916 -177.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 550' ' ' GLN . . . . . 0.517 ' HG2' ' O ' ' B' ' 547' ' ' ILE . 7.5 pt20 -87.08 -9.55 55.12 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.598 0.592 . . . . 2.27 112.598 -175.26 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -120.38 59.69 6.99 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.773 1.027 . . . . 3.5299999999999998 113.773 -176.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 552' ' ' PRO . . . . . 0.466 ' HD3' ' C ' ' B' ' 550' ' ' GLN . 44.6 Cg_exo -55.96 -39.35 91.72 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.068 0.509 . . . . 0.46000000000000002 113.139 177.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -56.32 -46.67 79.77 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.153 0.501 . . . . 3.8700000000000001 109.968 -174.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -48.93 -59.79 3.3 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 123.956 0.902 . . . . 0.69999999999999996 112.113 167.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 555' ' ' LEU . . . . . 0.617 HD11 HG22 ' B' ' 548' ' ' VAL . 77.4 mt -54.33 -48.6 71.2 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.281 -0.418 . . . . 1.49 110.17 -178.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 556' ' ' ARG . . . . . 0.44 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 46.5 ttp180 -53.91 -35.9 62.14 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.752 1.019 . . . . 3.0899999999999999 113.752 -178.239 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.05 -12.13 51.02 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.513 -0.475 . . . . 0.0 112.08 -177.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 558' ' ' HIS . . . . . 0.481 ' ND1' ' HB2' ' B' ' 561' ' ' PHE . 18.7 t-160 -128.28 78.45 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.399 1.259 . . . . 2.9300000000000002 114.399 -177.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 559' ' ' TRP . . . . . 0.413 ' HB2' ' OE1' ' B' ' 603' ' ' GLN . 17.2 p90 -50.39 -48.3 56.02 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 116.613 2.079 . . . . 3.1099999999999999 116.613 -176.114 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 24.1 ttmm -56.6 -36.69 69.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.265 -0.425 . . . . 3.3199999999999998 111.073 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 561' ' ' PHE . . . . . 0.556 ' O ' HG13 ' B' ' 565' ' ' VAL . 0.1 OUTLIER -74.91 -45.08 45.02 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.061 -1.055 . . . . 1.25 111.897 175.68 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 562' ' ' LEU . . . . . 0.855 ' O ' HG22 ' B' ' 565' ' ' VAL . 6.4 tt -49.94 -59.12 4.17 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 122.459 0.304 . . . . 1.3200000000000001 110.338 175.023 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -50.22 -38.64 41.31 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.863 1.061 . . . . 2.7400000000000002 113.863 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 37.8 m -71.81 -39.42 69.86 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.487 0.66 . . . . 1.24 110.294 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 565' ' ' VAL . . . . . 0.855 HG22 ' O ' ' B' ' 562' ' ' LEU . 4.8 m -62.85 -41.28 91.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.687 -0.688 . . . . 1.1899999999999999 112.529 173.42 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 566' ' ' VAL . . . . . 0.557 HG22 HD12 ' B' ' 591' ' ' ILE . 47.9 t -71.06 -50.84 39.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 C-N-CA 120.537 -0.465 . . . . 1.3600000000000001 110.798 -176.481 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -51.04 -37.42 45.26 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.035 -0.53 . . . . 1.9399999999999999 112.067 170.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -72.72 -32.58 65.82 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.736 -0.468 . . . . 3.5299999999999998 109.736 -179.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 569' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' B' ' 565' ' ' VAL . 71.3 mt -67.52 -36.53 81.23 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 108.648 -0.871 . . . . 2.0099999999999998 108.648 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -65.29 -39.34 92.42 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.915 -0.402 . . . . 3.77 109.915 178.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.68 -53.58 56.63 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 120.011 -0.676 . . . . 2.4700000000000002 110.465 176.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 572' ' ' PHE . . . . . 0.559 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 23.5 m-85 -62.44 -9.9 9.91 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.121 1.156 . . . . 1.23 114.121 -177.135 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 573' ' ' MET . . . . . 0.605 ' HB3' HD21 ' B' ' 625' ' ' LEU . 67.9 mtt -76.39 -5.34 46.86 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.648 0.737 . . . . 2.1099999999999999 109.641 178.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -109.43 -0.57 18.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.815 -1.084 . . . . 3.2000000000000002 111.431 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 575' ' ' GLU . . . . . 0.753 ' HB3' HG21 ' B' ' 580' ' ' VAL . 48.4 mm-40 -68.59 130.24 42.26 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 116.195 -0.457 . . . . 1.55 110.124 177.514 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 64.0 p -87.89 -21.21 25.1 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.026 0.75 . . . . 1.3999999999999999 113.026 -177.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 577' ' ' HIS . . . . . 0.694 ' O ' HG22 ' B' ' 580' ' ' VAL . 64.7 t-80 -60.21 128.0 34.62 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.402 0.62 . . . . 2.8500000000000001 112.528 -175.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -44.85 125.86 5.33 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.397 -0.82 . . . . 2.1499999999999999 113.139 -171.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.72 4.76 Favored Glycine 0 C--O 1.223 -0.567 0 N-CA-C 116.299 1.28 . . . . 0.0 116.299 175.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 580' ' ' VAL . . . . . 0.753 HG21 ' HB3' ' B' ' 575' ' ' GLU . 23.5 m -53.81 -46.31 63.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.096 0.776 . . . . 1.29 113.096 -175.456 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.495 ' N ' HG23 ' B' ' 580' ' ' VAL . 75.4 mt-30 -59.67 -42.3 92.56 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.371 0.508 . . . . 1.99 112.371 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -60.54 -42.4 96.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 112.232 0.456 . . . . 2.23 112.232 172.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 7.2 tpt -60.68 -49.51 77.21 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.084 -0.246 . . . . 2.5800000000000001 110.453 175.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.7 -43.0 80.11 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.129 -0.487 . . . . 0.029999999999999999 111.81 -177.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 50.2 t -74.35 -40.93 61.82 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.03 -0.668 . . . . 1.5 112.004 -177.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 586' ' ' ASP . . . . . 0.619 ' O ' HG22 ' B' ' 589' ' ' ILE . 0.7 OUTLIER -59.6 -46.29 89.4 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.249 -0.432 . . . . 1.98 111.974 -179.899 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 587' ' ' THR . . . . . 0.762 HG21 ' HB3' ' B' ' 545' ' ' MET . 41.7 p -62.23 -41.23 98.23 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.372 0.669 . . . . 1.3 110.358 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 588' ' ' PHE . . . . . 0.542 ' HA ' HG12 ' B' ' 591' ' ' ILE . 88.2 t80 -61.46 -32.15 72.14 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.118 -0.492 . . . . 0.53000000000000003 111.186 -177.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 589' ' ' ILE . . . . . 0.619 HG22 ' O ' ' B' ' 586' ' ' ASP . 20.1 tt -79.87 -35.95 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.878 -1.929 . . . . 1.97 109.8 -175.418 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -57.56 -49.86 74.99 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 107.779 -1.193 . . . . 2.6200000000000001 107.779 176.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 591' ' ' ILE . . . . . 0.557 HD12 HG22 ' B' ' 566' ' ' VAL . 34.5 pt -63.91 -43.64 97.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.784 0.661 . . . . 1.96 112.784 -176.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 592' ' ' ALA . . . . . 0.498 ' N ' HG13 ' B' ' 591' ' ' ILE . . . -63.94 -39.17 93.53 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.535 -0.466 . . . . 0.0 112.217 177.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -62.3 -70.14 0.22 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.14 -1.024 . . . . 2.3599999999999999 109.795 174.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -56.13 -23.72 36.28 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 116.623 2.082 . . . . 2.1899999999999999 116.623 -176.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 74.8 m -121.66 25.15 9.44 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 114.331 1.234 . . . . 1.26 114.331 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -48.5 -38.52 20.4 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.887 1.81 . . . . 3.5800000000000001 115.887 -172.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 597' ' ' ARG . . . . . 0.422 ' O ' ' HG2' ' B' ' 601' ' ' GLN . 34.5 ttm180 -69.56 -32.63 71.52 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.242 0.831 . . . . 3.7400000000000002 113.242 -175.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 598' ' ' HIS . . . . . 0.44 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 57.2 m-70 -70.07 -3.84 18.37 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.595 -0.73 . . . . 2.1400000000000001 112.107 -173.663 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -105.54 -16.88 14.59 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 123.597 0.561 . . . . 2.9500000000000002 110.231 -176.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 35.8 m -105.9 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.11 -0.95 . . . . 1.4199999999999999 111.276 -175.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 601' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 29.3 pt20 -102.05 139.52 37.57 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 119.563 -0.855 . . . . 2.3399999999999999 111.561 176.444 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 7.4 m -60.95 122.74 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.597 -0.89 . . . . 1.3700000000000001 108.597 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 603' ' ' GLN . . . . . 0.413 ' OE1' ' HB2' ' B' ' 559' ' ' TRP . 10.6 pt20 -92.79 167.31 11.95 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.631 0.582 . . . . 2.6800000000000002 110.048 -177.553 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 41.3 t -71.99 129.01 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 N-CA-C 112.958 0.725 . . . . 1.27 112.958 -175.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.35 6.52 64.44 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.059 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 606' ' ' GLU . . . . . 0.537 ' HG3' ' H ' ' B' ' 608' ' ' MET . 8.7 tp10 -131.44 157.97 42.06 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.639 -0.825 . . . . 2.5099999999999998 110.808 175.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 607' ' ' VAL . . . . . 0.538 HG13 ' HG2' ' B' ' 608' ' ' MET . 13.9 p -103.26 -22.46 4.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.097 -0.956 . . . . 1.3999999999999999 112.49 -175.164 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 608' ' ' MET . . . . . 0.538 ' HG2' HG13 ' B' ' 607' ' ' VAL . 22.2 mmt -137.02 142.22 37.57 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.601 0.593 . . . . 2.6800000000000002 112.601 -174.221 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 609' ' ' PRO . . . . . 0.542 ' HB2' HG22 ' B' ' 611' ' ' ILE . 9.7 Cg_endo -52.08 130.9 36.93 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.42999999999999999 112.131 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -57.0 -31.84 65.5 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 111.823 0.305 . . . . 2.3700000000000001 111.823 -174.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 611' ' ' ILE . . . . . 0.542 HG22 ' HB2' ' B' ' 609' ' ' PRO . 14.0 tt -50.0 -44.93 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 CA-C-O 120.816 0.341 . . . . 1.8400000000000001 110.496 178.229 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 612' ' ' ASP . . . . . 0.413 ' N ' HG23 ' B' ' 611' ' ' ILE . 20.9 t70 -49.88 -52.0 36.23 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.646 0.778 . . . . 2.1499999999999999 112.875 177.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 613' ' ' GLU . . . . . 0.457 ' O ' ' ND2' ' B' ' 617' ' ' ASN . 10.5 mm-40 -59.95 -37.13 78.67 Favored 'General case' 0 C--O 1.244 0.795 0 C-N-CA 120.59 -0.444 . . . . 2.6600000000000001 110.189 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 73.0 mt -64.45 -48.05 86.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 C-N-CA 120.262 -0.575 . . . . 1.76 111.973 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 59.8 tp -62.6 -31.13 71.91 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.03 0.752 . . . . 1.8400000000000001 113.03 -177.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -79.6 2.16 23.4 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.639 1.348 . . . . 2.0600000000000001 114.639 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 617' ' ' ASN . . . . . 0.457 ' ND2' ' O ' ' B' ' 613' ' ' GLU . 29.8 p30 -142.42 15.67 2.02 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.117 0.784 . . . . 1.97 113.117 -174.283 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 618' ' ' ILE . . . . . 0.469 HG23 ' N ' ' B' ' 619' ' ' ASN . 13.5 tt -46.87 -46.98 8.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.0099999999999998 110.263 -176.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 619' ' ' ASN . . . . . 0.469 ' N ' HG23 ' B' ' 618' ' ' ILE . 22.7 p-10 -63.24 -51.06 67.74 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.754 1.02 . . . . 2.2799999999999998 113.754 -176.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 620' ' ' THR . . . . . 0.423 ' OG1' ' HB2' ' B' ' 617' ' ' ASN . 56.8 p -56.94 -31.9 65.43 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.46 -0.896 . . . . 1.3200000000000001 110.741 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 621' ' ' ILE . . . . . 0.518 HG13 HG23 ' B' ' 622' ' ' ILE . 32.0 pt -79.27 -42.65 23.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.373 1.62 . . . . 2.0 115.373 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 622' ' ' ILE . . . . . 0.518 HG23 HG13 ' B' ' 621' ' ' ILE . 34.7 pt -87.67 -6.25 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 115.069 1.507 . . . . 2.0899999999999999 115.069 -177.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 40.2 t -19.98 -58.32 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.567 2.062 . . . . 1.47 116.567 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.23 -7.65 26.16 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.037 -1.438 . . . . 2.0699999999999998 110.994 -163.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 625' ' ' LEU . . . . . 0.605 HD21 ' HB3' ' B' ' 573' ' ' MET . 82.7 mt -71.78 146.9 47.78 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 123.311 0.382 . . . . 1.6699999999999999 111.773 -173.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 626' ' ' GLN . . . . . 0.531 ' HB3' ' HD2' ' B' ' 627' ' ' PRO . 97.2 mt-30 -76.75 162.1 71.64 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 108.827 -0.805 . . . . 2.3500000000000001 108.827 174.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 627' ' ' PRO . . . . . 0.531 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 6.3 Cg_endo -47.85 -43.55 29.14 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.823 1.432 . . . . 0.44 115.823 -178.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -67.32 -43.08 82.52 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.615 -0.513 . . . . 2.6200000000000001 109.615 -174.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -63.29 -38.29 90.58 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.951 -0.568 . . . . 2.0600000000000001 110.9 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 630' ' ' VAL . . . . . 0.459 HG23 ' O ' ' B' ' 626' ' ' GLN . 80.9 t . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.237 -0.887 . . . . 1.3 110.67 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.466 -0.254 . . . . 9.8599999999999994 112.466 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.9 t -135.69 111.55 9.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.752 0.31 . . . . 8.7799999999999994 110.799 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.71 128.69 39.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 6.8200000000000003 111.126 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.4 p -64.37 130.06 42.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 6.25 111.054 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.74 120.86 0.36 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.791 -0.719 . . . . 4.1200000000000001 112.587 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -101.22 -45.74 5.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.722 0.296 . . . . 4.0300000000000002 110.925 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.638 ' HG ' HD22 ' A' ' 10' ' ' LEU . 7.4 mp -73.32 -8.98 58.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.279 -0.419 . . . . 2.21 110.891 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -54.89 -41.96 71.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.064 -0.517 . . . . 3.79 111.232 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.433 ' HG3' HD12 ' A' ' 10' ' ' LEU . 10.3 pt-20 -79.97 -22.65 42.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.309 -0.405 . . . . 4.1699999999999999 111.056 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.638 HD22 ' HG ' ' A' ' 7' ' ' LEU . 10.8 mp -63.58 -23.72 67.5 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.182 -0.463 . . . . 2.5800000000000001 111.047 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.02 -31.63 44.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 2.8399999999999999 111.374 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 24.7 tp -67.13 -18.36 65.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.817 0.341 . . . . 3.6699999999999999 110.715 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -80.71 -39.08 27.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.139 -0.482 . . . . 4.9299999999999997 111.491 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.549 HD21 ' HD3' ' B' ' 568' ' ' LYS . 8.5 tt -60.1 -24.77 64.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.482 -0.326 . . . . 3.27 110.916 -179.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.42 -30.99 54.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 3.1299999999999999 111.093 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -94.54 58.43 1.91 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.761 -0.733 . . . . 2.4700000000000002 112.437 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.571 HD23 ' HD2' ' B' ' 568' ' ' LYS . 14.3 tp -140.02 102.2 4.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.016 0.436 . . . . 2.1400000000000001 110.819 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -155.35 140.67 17.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.857 -0.61 . . . . 3.9199999999999999 110.755 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 15.7 mm -78.56 -13.75 13.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 3.25 110.875 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -148.31 134.96 19.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.128 -0.487 . . . . 5.9500000000000002 110.764 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -74.55 104.5 5.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.324 -0.398 . . . . 9.3900000000000006 110.735 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.7 m -94.94 130.63 41.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.141 -0.482 . . . . 8.9700000000000006 111.149 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -73.13 96.63 2.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.246 -0.433 . . . . 11.67 110.72 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 168.64 127.4 0.91 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.782 -0.723 . . . . 12.859999999999999 112.493 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -107.36 -22.54 12.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.724 0.297 . . . . 15.369999999999999 110.976 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -65.2 160.2 21.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 16.539999999999999 110.868 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 50.5 t . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.231 -0.89 . . . . 17.93 110.802 179.966 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 504' ' ' ILE . . . . . 0.461 ' N ' HD13 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.277 0 N-CA-C 113.094 0.776 . . . . 2.1299999999999999 113.094 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 74.9 m -48.84 119.11 2.94 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.519 0.563 . . . . 1.29 112.519 174.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.79 1.5 67.86 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 120.948 -0.644 . . . . 0.0 114.501 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.4 -7.57 41.21 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 117.549 0.674 . . . . 0.02 112.444 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 24.8 mmt -112.43 159.98 18.2 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.22 0.533 . . . . 2.21 112.262 174.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -69.64 134.28 48.53 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 109.051 -0.722 . . . . 2.6699999999999999 109.051 174.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.78 -35.39 0.79 Allowed 'General case' 0 C--O 1.239 0.533 0 N-CA-C 113.37 0.878 . . . . 2.6600000000000001 113.37 -173.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -73.82 -41.88 61.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.531 -0.759 . . . . 2.4399999999999999 112.1 -176.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -64.85 -40.18 94.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.182 0.515 . . . . 2.0800000000000001 110.873 171.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -53.7 -48.61 69.38 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.285 -0.87 . . . . 1.9199999999999999 111.107 177.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 514' ' ' LYS . . . . . 0.431 ' HE2' ' NE2' ' B' ' 558' ' ' HIS . 9.9 mtpm? -54.86 -57.67 10.66 Favored 'General case' 0 C--O 1.241 0.65 0 N-CA-C 111.889 0.329 . . . . 2.73 111.889 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 515' ' ' ARG . . . . . 0.445 ' O ' HG23 ' B' ' 519' ' ' THR . 74.5 mtp180 -56.63 -35.85 68.81 Favored 'General case' 0 CA--C 1.504 -0.817 0 O-C-N 124.129 0.893 . . . . 3.75 111.138 -177.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -76.15 -45.63 32.62 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.151 -0.932 . . . . 1.8899999999999999 110.515 -173.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 517' ' ' LEU . . . . . 0.622 ' HA ' HG12 ' B' ' 520' ' ' VAL . 8.2 tt -66.68 -32.26 73.46 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.761 -0.654 . . . . 1.8999999999999999 112.64 177.134 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 518' ' ' VAL . . . . . 0.52 HG13 HD21 ' A' ' 10' ' ' LEU . 44.6 t -67.47 -35.1 72.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 118.515 -1.274 . . . . 1.3999999999999999 109.081 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 519' ' ' THR . . . . . 0.445 HG23 ' O ' ' B' ' 515' ' ' ARG . 75.9 p -72.93 -36.42 67.22 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.451 0.643 . . . . 1.1799999999999999 112.42 178.475 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 520' ' ' VAL . . . . . 0.638 HG13 HG23 ' B' ' 521' ' ' ILE . 9.8 p -71.18 -42.36 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 O-C-N 122.094 -0.379 . . . . 1.22 111.673 -174.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 521' ' ' ILE . . . . . 0.638 HG23 HG13 ' B' ' 520' ' ' VAL . 26.2 pt -90.64 -25.8 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.442 1.645 . . . . 1.98 115.442 -175.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -60.82 -35.21 75.95 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.657 -0.868 . . . . 2.5699999999999998 108.657 173.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 523' ' ' ASP . . . . . 0.457 ' O ' HD23 ' B' ' 527' ' ' LEU . 10.0 m-20 -92.43 -21.46 20.18 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.987 1.477 . . . . 2.1699999999999999 114.987 -177.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 524' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' B' ' 520' ' ' VAL . 84.3 mt -70.6 -45.46 65.27 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 109.275 -0.639 . . . . 1.48 109.275 169.019 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 525' ' ' LEU . . . . . 0.683 HD22 HD13 ' B' ' 544' ' ' ILE . 3.7 mm? -52.16 -45.46 65.08 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.28 0.562 . . . . 1.95 110.97 169.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.5 -40.59 94.34 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 -178.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 527' ' ' LEU . . . . . 0.457 HD23 ' O ' ' B' ' 523' ' ' ASP . 2.5 mm? -63.57 -36.12 82.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 1.6699999999999999 111.47 175.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 528' ' ' CYS . . . . . 0.406 ' HA ' HG21 ' B' ' 540' ' ' ILE . 44.1 t -63.55 -47.6 80.9 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.041 -0.527 . . . . 0.58999999999999997 110.709 -175.282 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -61.78 -29.57 70.23 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.518 -0.764 . . . . 2.5 112.585 173.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -71.64 -54.76 9.35 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.358 0.873 . . . . 2.2400000000000002 113.358 -177.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -68.77 137.97 54.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.97 -0.559 . . . . 2.2799999999999998 111.002 -177.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 532' ' ' ARG . . . . . 0.434 ' HG2' ' N ' ' B' ' 533' ' ' GLY . 52.6 ttt180 -96.43 160.74 14.25 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.773 -0.649 . . . . 4.21 110.208 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 533' ' ' GLY . . . . . 0.434 ' N ' ' HG2' ' B' ' 532' ' ' ARG . . . 87.46 119.63 1.36 Allowed Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 115.982 -0.554 . . . . 0.0 113.954 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 534' ' ' LYS . . . . . 0.731 ' HD3' ' H ' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.04 -36.72 8.31 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.172 0.804 . . . . 2.9500000000000002 113.172 177.234 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -50.61 -51.8 45.33 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.868 -0.52 . . . . 2.2000000000000002 110.809 174.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 536' ' ' ASN . . . . . 0.581 ' O ' HG22 ' B' ' 539' ' ' ILE . 40.0 m-80 -66.13 -44.77 83.26 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.603 0.594 . . . . 1.47 112.603 178.322 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 537' ' ' LYS . . . . . 0.565 ' HA ' HG22 ' B' ' 540' ' ' ILE . 96.8 mttt -67.88 -31.95 72.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.427 -0.509 . . . . 2.5 110.331 -174.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.08 -46.97 69.53 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.822 -0.626 . . . . 0.040000000000000001 111.149 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 539' ' ' ILE . . . . . 0.581 HG22 ' O ' ' B' ' 536' ' ' ASN . 10.2 tp -58.1 -54.99 24.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 121.542 0.687 . . . . 1.8200000000000001 111.26 173.389 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 540' ' ' ILE . . . . . 0.565 HG22 ' HA ' ' B' ' 537' ' ' LYS . 10.0 tp -56.83 -48.07 81.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 121.672 -0.642 . . . . 1.8500000000000001 110.581 -178.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 541' ' ' ALA . . . . . 0.427 ' N ' HG23 ' B' ' 540' ' ' ILE . . . -57.55 -44.03 84.9 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 113.545 0.943 . . . . 0.02 113.545 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 542' ' ' SER . . . . . 0.478 ' HA ' ' HG2' ' B' ' 583' ' ' MET . 96.0 p -60.47 -38.72 85.14 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.625 -0.43 . . . . 1.2 110.297 -178.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 543' ' ' ASN . . . . . 0.45 ' O ' HG12 ' B' ' 547' ' ' ILE . 27.4 t-20 -69.08 -47.08 66.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 114.339 1.237 . . . . 2.0299999999999998 114.339 -175.24 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 544' ' ' ILE . . . . . 0.683 HD13 HD22 ' B' ' 525' ' ' LEU . 45.2 mt -52.71 -45.88 49.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.479 -0.934 . . . . 1.8100000000000001 108.479 170.043 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 545' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -64.02 -42.32 97.14 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.778 -0.769 . . . . 2.6000000000000001 112.766 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -58.33 -48.81 79.34 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 119.234 -0.986 . . . . 2.0800000000000001 109.845 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 547' ' ' ILE . . . . . 0.45 HG12 ' O ' ' B' ' 543' ' ' ASN . 44.8 mm -55.06 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.77 0.656 . . . . 1.5 112.77 179.208 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 548' ' ' VAL . . . . . 0.526 HG12 HD11 ' B' ' 555' ' ' LEU . 86.4 t -47.37 -44.22 8.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 C-N-CA 119.837 -0.745 . . . . 1.3999999999999999 111.454 176.281 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.41 -28.08 58.9 Favored Glycine 0 C--O 1.237 0.319 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -87.06 -9.48 55.35 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.571 0.582 . . . . 2.27 112.571 -175.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -120.4 59.64 7.0 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 113.79 1.033 . . . . 3.5299999999999998 113.79 -176.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -56.04 -39.3 92.05 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 O-C-N 122.189 0.573 . . . . 0.46000000000000002 113.132 178.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -56.39 -46.66 80.01 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 121.074 0.464 . . . . 3.8700000000000001 109.924 -174.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -48.9 -59.75 3.33 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 123.896 0.879 . . . . 0.69999999999999996 112.125 167.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 555' ' ' LEU . . . . . 0.607 ' HB3' HD13 ' B' ' 562' ' ' LEU . 83.8 mt -54.38 -48.58 71.36 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.304 -0.407 . . . . 1.49 110.158 -178.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 556' ' ' ARG . . . . . 0.472 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 76.8 ttt180 -53.83 -35.91 61.97 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 113.814 1.042 . . . . 3.0899999999999999 113.814 -178.302 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.09 -12.13 50.91 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.486 -0.486 . . . . 0.0 112.08 -177.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 558' ' ' HIS . . . . . 0.431 ' NE2' ' HE2' ' B' ' 514' ' ' LYS . 94.7 m-70 -128.28 78.48 1.84 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.405 1.261 . . . . 2.9300000000000002 114.405 -177.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 38.8 p90 -50.55 -48.25 57.48 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.505 2.039 . . . . 3.1099999999999999 116.505 -176.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.66 -36.62 69.76 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.378 -0.374 . . . . 3.3199999999999998 111.132 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 561' ' ' PHE . . . . . 0.465 ' O ' HG23 ' B' ' 565' ' ' VAL . 0.6 OUTLIER -74.9 -45.13 44.83 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 119.16 -1.016 . . . . 1.25 111.952 175.575 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 562' ' ' LEU . . . . . 0.607 HD13 ' HB3' ' B' ' 555' ' ' LEU . 58.5 tp -49.94 -59.22 4.07 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 122.428 0.291 . . . . 1.3200000000000001 110.264 174.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -50.11 -38.73 40.23 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.835 1.05 . . . . 2.7400000000000002 113.835 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 87.4 m -71.75 -39.35 70.09 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.553 0.692 . . . . 1.24 110.429 -176.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 565' ' ' VAL . . . . . 0.465 HG11 HG11 ' B' ' 548' ' ' VAL . 67.2 t -62.92 -41.15 91.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.618 -0.719 . . . . 1.1899999999999999 112.551 173.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 566' ' ' VAL . . . . . 0.478 HG23 ' O ' ' B' ' 562' ' ' LEU . 43.1 t -71.08 -50.89 39.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 120.546 -0.462 . . . . 1.3600000000000001 110.819 -176.53 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 567' ' ' ASN . . . . . 0.404 ' O ' ' HG2' ' B' ' 571' ' ' GLU . 49.8 t30 -51.1 -37.39 45.58 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.951 -0.568 . . . . 1.9399999999999999 112.029 170.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 568' ' ' LYS . . . . . 0.571 ' HD2' HD23 ' A' ' 17' ' ' LEU . 33.1 ttpt -72.6 -32.77 66.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.67 -0.493 . . . . 3.5299999999999998 109.67 -179.208 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 569' ' ' LEU . . . . . 0.84 HD11 ' O ' ' B' ' 584' ' ' ALA . 1.8 tm? -67.44 -36.46 81.26 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.739 -0.837 . . . . 2.0099999999999998 108.739 177.107 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 570' ' ' PHE . . . . . 0.439 ' CE2' HG12 ' B' ' 566' ' ' VAL . 24.6 m-85 -65.41 -39.31 92.0 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.863 -0.421 . . . . 3.77 109.863 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' B' ' 567' ' ' ASN . 18.7 mm-40 -57.67 -53.56 56.78 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 119.908 -0.717 . . . . 2.4700000000000002 110.479 176.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -62.36 -10.03 10.02 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.108 1.151 . . . . 1.23 114.108 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 573' ' ' MET . . . . . 0.794 ' HB3' HD11 ' B' ' 625' ' ' LEU . 18.0 mtm -76.35 -5.34 46.74 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.616 0.722 . . . . 2.1099999999999999 109.641 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 29.6 m-70 -109.42 -0.61 18.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.815 -1.084 . . . . 3.2000000000000002 111.452 173.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 575' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -68.51 130.2 42.18 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.212 -0.449 . . . . 1.55 110.083 177.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 7.9 t -87.81 -21.32 25.14 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.027 0.751 . . . . 1.3999999999999999 113.027 -177.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -60.19 128.02 34.71 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.409 0.623 . . . . 2.8500000000000001 112.532 -175.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -44.89 125.91 5.4 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.315 -0.857 . . . . 2.1499999999999999 113.011 -171.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.76 4.74 Favored Glycine 0 C--O 1.222 -0.643 0 N-CA-C 116.323 1.289 . . . . 0.0 116.323 174.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 45.2 t -53.72 -46.37 62.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 113.186 0.81 . . . . 1.29 113.186 -175.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.578 ' HB2' HE22 ' B' ' 629' ' ' GLN . 13.5 pt20 -59.63 -42.31 92.43 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.384 0.513 . . . . 1.99 112.384 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -60.46 -42.45 96.22 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.168 0.433 . . . . 2.23 112.168 172.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 583' ' ' MET . . . . . 0.478 ' HG2' ' HA ' ' B' ' 542' ' ' SER . 37.1 tpp -60.74 -49.42 77.59 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 121.027 -0.269 . . . . 2.5800000000000001 110.431 175.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 584' ' ' ALA . . . . . 0.84 ' O ' HD11 ' B' ' 569' ' ' LEU . . . -56.85 -42.96 80.65 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.162 -0.472 . . . . 0.029999999999999999 111.692 -177.159 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 52.6 t -74.36 -40.93 61.8 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 120.041 -0.664 . . . . 1.5 111.943 -177.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 586' ' ' ASP . . . . . 0.632 ' O ' HG22 ' B' ' 589' ' ' ILE . 15.5 t70 -59.7 -46.26 89.63 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.312 -0.404 . . . . 1.98 111.935 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 46.8 m -62.15 -41.23 98.09 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.433 0.693 . . . . 1.3 110.39 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -61.5 -32.17 72.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.075 -0.511 . . . . 0.53000000000000003 111.142 -177.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 589' ' ' ILE . . . . . 0.632 HG22 ' O ' ' B' ' 586' ' ' ASP . 8.9 tp -79.95 -35.91 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.847 -1.941 . . . . 1.97 109.854 -175.42 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 590' ' ' LYS . . . . . 0.457 ' HB3' ' NZ ' ' B' ' 590' ' ' LYS . 3.7 mmmp? -57.46 -49.99 74.49 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 107.747 -1.205 . . . . 2.6200000000000001 107.747 176.025 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 87.8 mt -63.83 -43.76 97.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.725 -0.671 . . . . 1.96 112.739 -176.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.14 93.45 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.512 -0.475 . . . . 0.0 112.244 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -62.26 -70.19 0.21 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.222 -0.991 . . . . 2.3599999999999999 109.796 174.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -56.1 -23.86 36.72 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.562 2.06 . . . . 2.1899999999999999 116.562 -176.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 75.0 m -121.68 25.24 9.38 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.261 1.208 . . . . 1.26 114.261 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -48.48 -38.54 20.32 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.861 1.8 . . . . 3.5800000000000001 115.861 -172.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -69.56 -32.66 71.57 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.186 0.809 . . . . 3.7400000000000002 113.186 -175.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 598' ' ' HIS . . . . . 0.472 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 55.1 m-70 -70.12 -3.85 18.6 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.617 -0.72 . . . . 2.1400000000000001 112.072 -173.603 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -105.58 -16.93 14.57 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.585 0.553 . . . . 2.9500000000000002 110.228 -176.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 46.5 t -105.82 -24.39 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.017 -0.992 . . . . 1.4199999999999999 111.295 -175.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -101.99 139.5 37.54 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.547 -0.861 . . . . 2.3399999999999999 111.599 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 4.3 p -60.91 122.7 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 N-CA-C 108.599 -0.889 . . . . 1.3700000000000001 108.599 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -92.68 167.3 11.99 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.706 0.629 . . . . 2.6800000000000002 110.138 -177.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.01 129.08 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 C-N-CA 119.881 -0.728 . . . . 1.27 112.907 -175.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.26 6.58 64.55 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.069 -175.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 606' ' ' GLU . . . . . 0.555 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.1 tp10 -131.46 158.03 41.92 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.611 -0.836 . . . . 2.5099999999999998 110.78 175.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 33.3 m -103.24 -22.58 4.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.13 -0.941 . . . . 1.3999999999999999 112.582 -175.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 608' ' ' MET . . . . . 0.555 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 23.2 ptt? -136.92 142.25 37.89 Favored Pre-proline 0 C--O 1.223 -0.297 0 N-CA-C 112.611 0.597 . . . . 2.6800000000000002 112.611 -174.234 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.08 130.89 36.92 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.42999999999999999 112.131 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 610' ' ' PHE . . . . . 0.459 ' CE2' HD11 ' B' ' 614' ' ' ILE . 16.5 t80 -57.01 -31.87 65.55 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.792 0.293 . . . . 2.3700000000000001 111.792 -174.135 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 611' ' ' ILE . . . . . 0.403 HG23 ' N ' ' B' ' 612' ' ' ASP . 11.8 tt -50.05 -44.8 22.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.85 0.357 . . . . 1.8400000000000001 110.56 178.253 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 612' ' ' ASP . . . . . 0.403 ' N ' HG23 ' B' ' 611' ' ' ILE . 16.7 t70 -49.92 -52.01 36.57 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.623 0.769 . . . . 2.1499999999999999 112.906 177.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -59.84 -37.17 78.47 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 120.604 -0.438 . . . . 2.6600000000000001 110.223 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 614' ' ' ILE . . . . . 0.459 HD11 ' CE2' ' B' ' 610' ' ' PHE . 31.9 mm -64.55 -47.98 86.87 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.181 -0.607 . . . . 1.76 111.922 178.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 8.4 tt -62.63 -31.11 71.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.98 0.733 . . . . 1.8400000000000001 112.98 -177.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -79.57 2.15 23.36 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.61 1.337 . . . . 2.0600000000000001 114.61 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -142.41 15.66 2.02 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 113.103 0.779 . . . . 1.97 113.103 -174.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 618' ' ' ILE . . . . . 0.502 ' N ' HD13 ' B' ' 618' ' ' ILE . 0.2 OUTLIER -47.0 -46.98 8.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 C-N-CA 118.957 -1.097 . . . . 2.0099999999999998 110.183 -176.663 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 619' ' ' ASN . . . . . 0.494 ' N ' HG12 ' B' ' 618' ' ' ILE . 6.0 p30 -63.19 -51.11 67.65 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.759 1.022 . . . . 2.2799999999999998 113.759 -176.385 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 76.3 p -56.85 -31.88 65.23 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 119.449 -0.9 . . . . 1.3200000000000001 110.804 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 621' ' ' ILE . . . . . 0.548 HG13 HG12 ' B' ' 622' ' ' ILE . 42.0 pt -79.35 -42.62 23.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.322 1.601 . . . . 2.0 115.322 -179.003 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 622' ' ' ILE . . . . . 0.694 ' HA ' HD13 ' B' ' 625' ' ' LEU . 19.7 mm -87.72 -6.26 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 115.035 1.494 . . . . 2.0899999999999999 115.035 -177.65 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.6 t -19.98 -58.29 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.567 2.062 . . . . 1.47 116.567 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -99.27 -7.58 26.18 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.063 -1.426 . . . . 2.0699999999999998 111.022 -163.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 625' ' ' LEU . . . . . 0.794 HD11 ' HB3' ' B' ' 573' ' ' MET . 8.3 mp -71.83 146.82 47.74 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.409 -0.36 . . . . 1.6699999999999999 111.7 -173.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 626' ' ' GLN . . . . . 0.724 ' O ' HG13 ' B' ' 630' ' ' VAL . 18.9 pt20 -76.65 162.13 71.68 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 108.814 -0.81 . . . . 2.3500000000000001 108.814 174.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 627' ' ' PRO . . . . . 0.787 ' O ' HG22 ' B' ' 630' ' ' VAL . 79.4 Cg_exo -47.96 -43.51 29.86 Favored 'Trans proline' 0 C--O 1.233 0.263 0 N-CA-C 115.827 1.434 . . . . 0.44 115.827 -178.469 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -67.33 -43.01 82.65 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.602 -0.518 . . . . 2.6200000000000001 109.602 -174.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 629' ' ' GLN . . . . . 0.578 HE22 ' HB2' ' B' ' 581' ' ' GLN . 28.9 mt-30 -63.23 -38.34 90.8 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.944 -0.571 . . . . 2.0600000000000001 110.928 178.65 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 630' ' ' VAL . . . . . 0.787 HG22 ' O ' ' B' ' 627' ' ' PRO . 1.0 OUTLIER . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.213 -0.898 . . . . 1.3 110.669 176.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.202 0 N-CA-C 112.377 -0.289 . . . . 9.8599999999999994 112.377 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.4 m -111.09 85.0 2.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.799 0.333 . . . . 8.7799999999999994 110.77 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -153.97 73.88 0.96 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.077 -0.51 . . . . 6.8200000000000003 111.009 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 77.4 p -118.79 -58.38 1.96 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.133 -0.485 . . . . 6.25 110.987 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -94.34 123.75 7.63 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.741 -0.742 . . . . 4.1200000000000001 112.512 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.405 ' O ' ' HG2' ' A' ' 9' ' ' GLU . 39.1 t-20 -164.48 -30.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.789 0.328 . . . . 4.0300000000000002 110.874 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.436 ' N ' HD12 ' A' ' 7' ' ' LEU . 6.7 mp -80.41 -9.57 59.75 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.36 -0.382 . . . . 2.21 111.077 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -56.57 -31.62 64.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.227 -0.442 . . . . 3.79 111.457 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 6' ' ' ASN . 10.0 pt-20 -79.37 -22.76 43.94 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.769 0.319 . . . . 4.1699999999999999 111.252 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.5 mt -66.08 -10.84 44.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.392 -0.367 . . . . 2.5800000000000001 111.062 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.79 -45.14 25.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 2.8399999999999999 111.38 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 69.2 mt -61.98 -14.36 34.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.321 -0.4 . . . . 3.6699999999999999 111.243 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.421 ' HE3' ' HG3' ' B' ' 522' ' ' LYS . 24.8 ttmm -79.78 -37.91 34.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 4.9299999999999997 111.097 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.536 HD23 ' HB ' ' B' ' 564' ' ' THR . 69.5 tp -60.92 -17.86 53.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.388 -0.369 . . . . 3.27 110.995 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.24 -27.61 35.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.324 -0.398 . . . . 3.1299999999999999 110.997 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -92.94 90.48 1.44 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.786 -0.721 . . . . 2.4700000000000002 112.307 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.401 ' HG ' ' HZ ' ' B' ' 572' ' ' PHE . 40.3 tp -165.73 87.79 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.06 0.457 . . . . 2.1400000000000001 110.842 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -137.31 131.08 31.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.927 -0.579 . . . . 3.9199999999999999 110.731 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.496 HG23 ' HB2' ' B' ' 537' ' ' LYS . 73.7 mt -83.33 -30.21 8.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.493 . . . . 3.25 111.139 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -79.84 -20.64 45.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.263 -0.426 . . . . 5.9500000000000002 111.571 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -63.22 126.8 28.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.686 0.279 . . . . 9.3900000000000006 110.943 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.2 t -156.63 -29.66 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.147 -0.479 . . . . 8.9700000000000006 110.849 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -117.89 130.6 56.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.96 -0.563 . . . . 11.67 110.74 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 118.57 115.85 2.66 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.781 -0.723 . . . . 12.859999999999999 112.479 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -84.58 122.05 28.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.727 0.298 . . . . 15.369999999999999 110.907 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -140.88 -39.29 0.42 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 16.539999999999999 110.846 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 52.1 t . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.289 -0.862 . . . . 17.93 111.002 -179.95 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 504' ' ' ILE . . . . . 0.939 HG13 ' HB3' ' B' ' 507' ' ' ALA . 8.0 tp . . . . . 0 C--O 1.236 0.342 0 N-CA-C 112.985 0.735 . . . . 2.1299999999999999 112.985 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 505' ' ' SER . . . . . 0.439 ' HB3' ' HG2' ' B' ' 550' ' ' GLN . 79.5 p -48.9 119.16 3.0 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.553 0.575 . . . . 1.29 112.553 174.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.86 1.38 67.78 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.92 -0.657 . . . . 0.0 114.407 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 507' ' ' ALA . . . . . 0.939 ' HB3' HG13 ' B' ' 504' ' ' ILE . . . -94.26 -7.6 41.55 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 117.677 0.738 . . . . 0.02 112.48 176.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 26.4 mmt -112.47 159.93 18.27 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.107 -0.497 . . . . 2.21 112.269 174.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 509' ' ' HIS . . . . . 0.405 ' HD2' ' HB2' ' B' ' 511' ' ' GLU . 82.3 t60 -69.7 134.24 48.43 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 109.14 -0.689 . . . . 2.6699999999999999 109.14 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 510' ' ' GLU . . . . . 0.486 ' HG2' ' HE2' ' B' ' 514' ' ' LYS . 40.6 tt0 -41.65 -35.43 0.76 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 113.375 0.88 . . . . 2.6600000000000001 113.375 -173.243 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 511' ' ' GLU . . . . . 0.405 ' HB2' ' HD2' ' B' ' 509' ' ' HIS . 0.6 OUTLIER -73.73 -42.03 61.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.621 -0.718 . . . . 2.4399999999999999 112.118 -176.587 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -64.84 -40.1 94.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.129 0.49 . . . . 2.0800000000000001 110.855 171.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 513' ' ' GLU . . . . . 0.411 ' O ' ' HG ' ' B' ' 517' ' ' LEU . 36.4 tt0 -53.72 -48.65 69.39 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.369 -0.832 . . . . 1.9199999999999999 111.183 177.36 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 514' ' ' LYS . . . . . 0.487 ' O ' HG23 ' B' ' 518' ' ' VAL . 66.3 mttm -54.84 -57.56 11.1 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 111.93 0.345 . . . . 2.73 111.93 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -56.66 -35.84 68.86 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 124.157 0.911 . . . . 3.75 111.116 -177.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -76.26 -45.51 32.35 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.121 -0.945 . . . . 1.8899999999999999 110.502 -173.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 517' ' ' LEU . . . . . 0.608 ' HA ' HG12 ' B' ' 520' ' ' VAL . 91.0 mt -66.77 -32.25 73.41 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.757 -0.656 . . . . 1.8999999999999999 112.596 177.156 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 518' ' ' VAL . . . . . 0.487 HG23 ' O ' ' B' ' 514' ' ' LYS . 78.5 t -67.45 -35.15 72.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 118.495 -1.282 . . . . 1.3999999999999999 109.021 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 41.4 p -72.98 -36.26 67.04 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.311 0.577 . . . . 1.1799999999999999 112.401 178.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 520' ' ' VAL . . . . . 0.608 HG12 ' HA ' ' B' ' 517' ' ' LEU . 9.3 p -71.3 -42.37 74.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 116.48 -0.327 . . . . 1.22 111.588 -174.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 521' ' ' ILE . . . . . 0.617 HG22 ' CD1' ' B' ' 547' ' ' ILE . 15.5 pt -90.57 -25.82 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 115.455 1.65 . . . . 1.98 115.455 -175.135 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 522' ' ' LYS . . . . . 0.421 ' HG3' ' HE3' ' A' ' 13' ' ' LYS . 34.1 ttmt -60.89 -35.16 75.91 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.682 -0.858 . . . . 2.5699999999999998 108.682 173.533 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -92.45 -21.49 20.15 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 114.988 1.477 . . . . 2.1699999999999999 114.988 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 77.5 mt -70.6 -45.36 65.44 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.295 -0.631 . . . . 1.48 109.295 168.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 83.9 mt -52.3 -45.45 65.54 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.222 0.534 . . . . 1.95 110.942 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.5 -40.54 94.34 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 73.4 mt -63.52 -36.18 82.94 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.033 0.444 . . . . 1.6699999999999999 111.437 175.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 42.3 t -63.47 -47.83 80.19 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.082 -0.508 . . . . 0.58999999999999997 110.63 -175.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.64 -29.6 70.16 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.438 -0.801 . . . . 2.5 112.616 173.832 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -71.72 -54.65 9.59 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.341 0.867 . . . . 2.2400000000000002 113.341 -177.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 17.1 tptp -68.76 137.95 54.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.008 -0.542 . . . . 2.2799999999999998 111.031 -177.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 532' ' ' ARG . . . . . 0.434 ' HA ' ' NZ ' ' B' ' 537' ' ' LYS . 16.3 ptp180 -96.43 160.72 14.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.765 -0.652 . . . . 4.21 110.19 178.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.39 119.58 1.34 Allowed Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.918 -0.583 . . . . 0.0 114.018 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 534' ' ' LYS . . . . . 0.409 ' HG2' HG22 ' A' ' 19' ' ' ILE . 56.9 mtpt -46.99 -36.71 8.07 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.187 0.81 . . . . 2.9500000000000002 113.187 177.205 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -50.53 -51.86 43.95 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 120.337 -0.545 . . . . 2.2000000000000002 110.799 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 -66.09 -44.82 83.3 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.621 0.601 . . . . 1.47 112.621 178.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 537' ' ' LYS . . . . . 0.496 ' HB2' HG23 ' A' ' 19' ' ' ILE . 63.1 mttp -67.8 -32.08 72.39 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.468 -0.493 . . . . 2.5 110.258 -174.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.1 -46.93 69.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.835 -0.62 . . . . 0.040000000000000001 111.117 178.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 45.4 mm -58.15 -54.97 25.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 121.622 0.725 . . . . 1.8200000000000001 111.315 173.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 540' ' ' ILE . . . . . . . . . . . . . 82.8 mt -56.73 -48.19 81.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.663 -0.648 . . . . 1.8500000000000001 110.592 -178.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.43 -44.05 84.35 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.577 0.954 . . . . 0.02 113.577 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 542' ' ' SER . . . . . 0.436 ' HA ' ' HG2' ' B' ' 583' ' ' MET . 88.9 p -60.5 -38.78 85.43 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.571 -0.451 . . . . 1.2 110.297 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -68.96 -47.09 66.5 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.407 1.262 . . . . 2.0299999999999998 114.407 -175.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 544' ' ' ILE . . . . . 0.49 ' O ' HG12 ' B' ' 547' ' ' ILE . 61.2 mt -52.67 -45.89 49.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.539 -0.912 . . . . 1.8100000000000001 108.539 170.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 545' ' ' MET . . . . . 0.837 ' HB3' HG21 ' B' ' 587' ' ' THR . 0.2 OUTLIER -64.08 -42.31 97.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.693 -0.803 . . . . 2.6000000000000001 112.825 179.389 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -58.19 -48.84 79.06 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 119.197 -1.001 . . . . 2.0800000000000001 109.962 176.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 547' ' ' ILE . . . . . 0.617 ' CD1' HG22 ' B' ' 521' ' ' ILE . 38.1 pt -55.02 -61.43 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.856 0.687 . . . . 1.5 112.856 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 548' ' ' VAL . . . . . 0.446 HG12 ' HA ' ' B' ' 545' ' ' MET . 10.2 p -47.3 -44.26 8.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 C-N-CA 119.784 -0.767 . . . . 1.3999999999999999 111.446 176.197 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.37 -28.07 58.8 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.823 -0.548 . . . . 0.0 112.976 -177.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 550' ' ' GLN . . . . . 0.439 ' HG2' ' HB3' ' B' ' 505' ' ' SER . 47.3 tt0 -87.01 -9.55 55.27 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 112.601 0.593 . . . . 2.27 112.601 -175.327 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -120.48 59.72 7.2 Favored Pre-proline 0 CA--C 1.536 0.44 0 N-CA-C 113.792 1.034 . . . . 3.5299999999999998 113.792 -176.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -55.97 -39.34 91.78 Favored 'Trans proline' 0 C--O 1.222 -0.311 0 O-C-N 122.122 0.538 . . . . 0.46000000000000002 113.246 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 17.0 tpp180 -56.35 -46.66 79.88 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 121.022 0.439 . . . . 3.8700000000000001 109.88 -174.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -49.0 -59.69 3.4 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 123.967 0.907 . . . . 0.69999999999999996 112.098 168.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 555' ' ' LEU . . . . . 0.401 ' HG ' ' CB ' ' B' ' 562' ' ' LEU . 4.7 tp -54.33 -48.64 71.15 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 116.272 -0.422 . . . . 1.49 110.219 -179.015 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 556' ' ' ARG . . . . . 0.597 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 64.9 ttt180 -53.84 -35.93 62.01 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 113.739 1.015 . . . . 3.0899999999999999 113.739 -178.228 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.06 -12.16 50.89 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.486 -0.486 . . . . 0.0 112.047 -177.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -128.24 78.56 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 2.9300000000000002 114.388 -177.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.57 -48.25 57.59 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.55 2.055 . . . . 3.1099999999999999 116.55 -176.041 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 560' ' ' LYS . . . . . 0.459 ' O ' HG23 ' B' ' 564' ' ' THR . 75.6 mmtt -56.68 -36.65 69.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 3.3199999999999998 111.121 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 561' ' ' PHE . . . . . 0.457 ' O ' HG23 ' B' ' 565' ' ' VAL . 1.2 t80 -74.82 -45.09 45.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.142 -1.023 . . . . 1.25 112.009 175.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 562' ' ' LEU . . . . . 0.532 HD21 ' HE1' ' B' ' 599' ' ' PHE . 9.6 tt -50.07 -59.04 4.29 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.597 -0.274 . . . . 1.3200000000000001 110.306 175.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -50.26 -38.62 41.78 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.805 1.039 . . . . 2.7400000000000002 113.805 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 564' ' ' THR . . . . . 0.536 ' HB ' HD23 ' A' ' 14' ' ' LEU . 26.1 p -71.76 -39.43 70.01 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.534 0.683 . . . . 1.24 110.38 -176.071 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 565' ' ' VAL . . . . . 0.457 HG23 ' O ' ' B' ' 561' ' ' PHE . 95.7 t -62.8 -41.37 92.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.577 -0.738 . . . . 1.1899999999999999 112.511 173.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 566' ' ' VAL . . . . . 0.559 HG22 HD12 ' B' ' 591' ' ' ILE . 46.3 t -70.99 -50.87 39.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 120.621 -0.432 . . . . 1.3600000000000001 110.795 -176.489 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -51.11 -37.43 45.93 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.075 -0.511 . . . . 1.9399999999999999 111.987 170.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -72.67 -32.63 65.96 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.733 -0.469 . . . . 3.5299999999999998 109.733 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 569' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' B' ' 565' ' ' VAL . 54.1 mt -67.51 -36.47 81.11 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 108.703 -0.851 . . . . 2.0099999999999998 108.703 177.072 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 570' ' ' PHE . . . . . 0.456 ' HD1' HG23 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.39 -39.43 92.21 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.851 -0.425 . . . . 3.77 109.851 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -57.52 -53.64 55.89 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 119.97 -0.692 . . . . 2.4700000000000002 110.52 176.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 572' ' ' PHE . . . . . 0.401 ' HZ ' ' HG ' ' A' ' 17' ' ' LEU . 3.1 m-85 -62.36 -9.99 9.9 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 114.092 1.145 . . . . 1.23 114.092 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 573' ' ' MET . . . . . 0.842 ' HB3' HD21 ' B' ' 625' ' ' LEU . 89.5 mtp -76.35 -5.37 46.84 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.614 0.721 . . . . 2.1099999999999999 109.641 178.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 60.6 m80 -109.39 -0.59 18.92 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.78 -1.1 . . . . 3.2000000000000002 111.465 173.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 575' ' ' GLU . . . . . 0.616 ' CG ' HG11 ' B' ' 580' ' ' VAL . 8.1 tp10 -68.46 130.18 42.11 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.193 -0.458 . . . . 1.55 110.162 177.495 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 72.4 p -87.84 -21.35 25.08 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 112.991 0.737 . . . . 1.3999999999999999 112.991 -177.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 577' ' ' HIS . . . . . 0.781 ' O ' HG12 ' B' ' 580' ' ' VAL . 11.8 t60 -60.2 128.03 34.76 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.364 0.602 . . . . 2.8500000000000001 112.596 -175.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -44.9 125.88 5.4 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.388 -0.824 . . . . 2.1499999999999999 113.103 -171.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.19 -34.65 4.81 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 116.207 1.243 . . . . 0.0 116.207 174.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 580' ' ' VAL . . . . . 0.781 HG12 ' O ' ' B' ' 577' ' ' HIS . 13.4 p -53.75 -46.34 62.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.154 0.798 . . . . 1.29 113.154 -175.526 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.525 ' N ' HG13 ' B' ' 580' ' ' VAL . 10.9 pt20 -59.67 -42.29 92.56 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.365 0.506 . . . . 1.99 112.365 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -60.56 -42.36 96.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 112.243 0.461 . . . . 2.23 112.243 172.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 583' ' ' MET . . . . . 0.436 ' HG2' ' HA ' ' B' ' 542' ' ' SER . 40.0 tpp -60.71 -49.45 77.47 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 121.126 -0.229 . . . . 2.5800000000000001 110.432 175.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.83 -43.06 80.68 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.196 -0.456 . . . . 0.029999999999999999 111.634 -177.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 52.2 t -74.32 -40.92 61.9 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 119.997 -0.681 . . . . 1.5 112.025 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -59.55 -46.41 88.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.415 . . . . 1.98 111.886 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 587' ' ' THR . . . . . 0.837 HG21 ' HB3' ' B' ' 545' ' ' MET . 81.4 p -62.16 -41.22 98.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.3 110.43 175.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 588' ' ' PHE . . . . . 0.545 ' HA ' HG12 ' B' ' 591' ' ' ILE . 88.7 t80 -61.5 -32.09 72.11 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.085 -0.507 . . . . 0.53000000000000003 111.189 -177.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 589' ' ' ILE . . . . . . . . . . . . . 48.5 mm -79.99 -35.87 16.4 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.89 -1.924 . . . . 1.97 109.806 -175.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -57.56 -50.01 74.5 Favored 'General case' 0 C--O 1.221 -0.438 0 N-CA-C 107.756 -1.201 . . . . 2.6200000000000001 107.756 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 591' ' ' ILE . . . . . 0.559 HD12 HG22 ' B' ' 566' ' ' VAL . 37.1 pt -63.74 -43.72 98.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.688 -0.687 . . . . 1.96 112.802 -177.029 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 592' ' ' ALA . . . . . 0.491 ' N ' HG13 ' B' ' 591' ' ' ILE . . . -63.96 -39.13 93.43 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.494 -0.482 . . . . 0.0 112.261 177.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -62.41 -70.02 0.22 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 119.096 -1.041 . . . . 2.3599999999999999 109.807 174.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -56.12 -23.82 36.72 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 116.587 2.069 . . . . 2.1899999999999999 116.587 -176.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.3 p -121.61 25.14 9.47 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 114.247 1.203 . . . . 1.26 114.247 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 596' ' ' ARG . . . . . 0.423 ' HE ' ' HA ' ' B' ' 596' ' ' ARG . 0.0 OUTLIER -48.5 -38.6 20.57 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.824 1.787 . . . . 3.5800000000000001 115.824 -172.404 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 597' ' ' ARG . . . . . 0.424 ' O ' HG12 ' B' ' 600' ' ' VAL . 24.1 tpp180 -69.48 -32.62 71.62 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.214 0.82 . . . . 3.7400000000000002 113.214 -175.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 598' ' ' HIS . . . . . 0.597 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 57.5 m-70 -70.15 -3.9 18.93 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.619 -0.719 . . . . 2.1400000000000001 112.05 -173.558 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 599' ' ' PHE . . . . . 0.532 ' HE1' HD21 ' B' ' 562' ' ' LEU . 6.1 m-85 -105.51 -16.96 14.57 Favored 'General case' 0 CA--C 1.516 -0.329 0 O-C-N 123.669 0.606 . . . . 2.9500000000000002 110.268 -176.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 600' ' ' VAL . . . . . 0.424 HG12 ' O ' ' B' ' 597' ' ' ARG . 9.3 p -105.84 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.039 -0.982 . . . . 1.4199999999999999 111.325 -175.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -101.95 139.53 37.46 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.547 -0.861 . . . . 2.3399999999999999 111.601 176.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 5.7 p -60.91 122.76 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.489 0 N-CA-C 108.577 -0.898 . . . . 1.3700000000000001 108.577 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -92.83 167.34 11.91 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 123.705 0.628 . . . . 2.6800000000000002 110.051 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 17.3 m -71.93 128.96 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 N-CA-C 112.981 0.734 . . . . 1.27 112.981 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.38 6.51 64.4 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.082 -175.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -131.55 158.04 42.0 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.555 -0.858 . . . . 2.5099999999999998 110.766 175.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 31.5 m -103.24 -22.56 4.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.093 -0.958 . . . . 1.3999999999999999 112.507 -175.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 608' ' ' MET . . . . . 0.46 ' HG3' ' HD2' ' B' ' 609' ' ' PRO . 59.6 ttp -136.99 142.26 37.79 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.643 0.609 . . . . 2.6800000000000002 112.643 -174.258 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 609' ' ' PRO . . . . . 0.46 ' HD2' ' HG3' ' B' ' 608' ' ' MET . 68.9 Cg_exo -52.09 130.92 37.03 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.928 1.085 . . . . 0.42999999999999999 112.094 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -57.01 -31.86 65.54 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.792 0.293 . . . . 2.3700000000000001 111.792 -174.138 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 611' ' ' ILE . . . . . 0.419 HG23 ' N ' ' B' ' 612' ' ' ASP . 14.0 tt -50.06 -44.75 22.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.814 0.34 . . . . 1.8400000000000001 110.592 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 612' ' ' ASP . . . . . 0.419 ' N ' HG23 ' B' ' 611' ' ' ILE . 20.8 m-20 -49.92 -52.11 35.7 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.632 0.773 . . . . 2.1499999999999999 112.854 177.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -59.84 -37.14 78.39 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.612 -0.435 . . . . 2.6600000000000001 110.21 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 41.6 mm -64.49 -48.04 86.71 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 120.169 -0.612 . . . . 1.76 111.946 178.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.57 -31.13 71.88 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.012 0.745 . . . . 1.8400000000000001 113.012 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -79.55 2.1 23.46 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.569 1.322 . . . . 2.0600000000000001 114.569 -179.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 36.5 p30 -142.42 15.59 2.02 Favored 'General case' 0 C--O 1.242 0.685 0 N-CA-C 113.143 0.794 . . . . 1.97 113.143 -174.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 618' ' ' ILE . . . . . 0.453 HG23 ' N ' ' B' ' 619' ' ' ASN . 10.7 tt -46.9 -46.99 8.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.0099999999999998 110.222 -176.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 619' ' ' ASN . . . . . 0.453 ' N ' HG23 ' B' ' 618' ' ' ILE . 45.4 t-20 -63.23 -51.06 67.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.754 1.02 . . . . 2.2799999999999998 113.754 -176.409 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 73.3 p -56.89 -31.88 65.31 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 119.455 -0.898 . . . . 1.3200000000000001 110.782 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 621' ' ' ILE . . . . . 0.456 HG23 ' HD1' ' B' ' 570' ' ' PHE . 17.7 mt -79.33 -42.64 23.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.334 1.605 . . . . 2.0 115.334 -179.018 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 622' ' ' ILE . . . . . 0.67 ' HA ' HD23 ' B' ' 625' ' ' LEU . 14.3 mt -87.69 -6.22 10.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.055 1.502 . . . . 2.0899999999999999 115.055 -177.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 44.1 t -20.0 -58.34 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 116.529 2.048 . . . . 1.47 116.529 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -99.21 -7.58 26.3 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.977 -1.465 . . . . 2.0699999999999998 111.027 -163.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 625' ' ' LEU . . . . . 0.842 HD21 ' HB3' ' B' ' 573' ' ' MET . 3.6 mm? -71.97 146.86 47.47 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.443 -0.344 . . . . 1.6699999999999999 111.689 -173.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 626' ' ' GLN . . . . . 0.642 ' O ' HG23 ' B' ' 630' ' ' VAL . 47.5 mt-30 -76.68 162.0 72.13 Favored Pre-proline 0 CA--C 1.519 -0.241 0 N-CA-C 108.834 -0.802 . . . . 2.3500000000000001 108.834 174.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 627' ' ' PRO . . . . . 0.558 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 5.4 Cg_endo -47.71 -43.67 28.12 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 N-CA-C 115.825 1.433 . . . . 0.44 115.825 -178.473 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -67.31 -43.07 82.56 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.563 -0.532 . . . . 2.6200000000000001 109.563 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -63.26 -38.29 90.57 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.946 -0.57 . . . . 2.0600000000000001 110.926 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 630' ' ' VAL . . . . . 0.642 HG23 ' O ' ' B' ' 626' ' ' GLN . 38.6 t . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.316 -0.85 . . . . 1.3 110.695 176.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 112.445 -0.262 . . . . 9.8599999999999994 112.445 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.8 m 58.17 -167.82 0.14 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.812 0.339 . . . . 8.7799999999999994 111.032 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.95 -170.09 2.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.233 -0.439 . . . . 6.8200000000000003 111.026 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.2 t -163.94 24.42 0.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 6.25 110.625 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -98.4 17.29 58.72 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.782 -0.723 . . . . 4.1200000000000001 112.45 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -143.81 -26.06 0.55 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.761 0.315 . . . . 4.0300000000000002 110.947 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.59 HD12 HD11 ' A' ' 10' ' ' LEU . 20.4 tp -73.4 -16.4 61.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 2.21 110.82 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -80.69 -40.2 25.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.25 -0.432 . . . . 3.79 111.545 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.51 -50.07 71.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.418 -0.355 . . . . 4.1699999999999999 111.507 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.59 HD11 HD12 ' A' ' 7' ' ' LEU . 2.1 pp -66.55 -9.9 39.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.436 -0.347 . . . . 2.5800000000000001 111.349 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.27 -13.92 59.65 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.85 0.357 . . . . 2.8399999999999999 111.215 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 18.5 tp -67.39 -10.28 49.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 3.6699999999999999 110.947 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -77.38 -39.68 46.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.096 -0.502 . . . . 4.9299999999999997 111.509 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.556 HD12 ' HB ' ' B' ' 564' ' ' THR . 2.3 tm? -58.17 -35.27 71.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.462 -0.336 . . . . 3.27 110.826 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.92 -13.33 10.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.341 -0.39 . . . . 3.1299999999999999 111.4 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -113.85 105.43 1.6 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.775 -0.726 . . . . 2.4700000000000002 112.707 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 tt -166.72 118.34 0.96 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.803 0.335 . . . . 2.1400000000000001 110.381 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -152.19 140.93 20.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.239 -0.437 . . . . 3.9199999999999999 111.045 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.456 ' HA ' ' HB3' ' B' ' 537' ' ' LYS . 4.5 mp -91.67 -17.58 7.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.069 -0.514 . . . . 3.25 110.857 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.417 ' HB2' ' HE1' ' B' ' 577' ' ' HIS . 36.6 t30 -143.88 102.74 3.95 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.365 -0.379 . . . . 5.9500000000000002 111.179 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -172.96 140.98 0.95 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.292 -0.413 . . . . 9.3900000000000006 110.797 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 64.3 p -92.33 42.58 1.11 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.985 0.422 . . . . 8.9700000000000006 111.176 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -103.39 103.61 13.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 11.67 110.856 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -157.04 101.0 0.2 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.919 -0.658 . . . . 12.859999999999999 112.46 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -146.26 -167.76 2.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.836 0.35 . . . . 15.369999999999999 111.208 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -63.87 122.77 17.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.267 -0.424 . . . . 16.539999999999999 110.867 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 51.7 t . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.297 -0.859 . . . . 17.93 110.91 -179.76 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 504' ' ' ILE . . . . . 0.861 HG12 ' HB3' ' B' ' 507' ' ' ALA . 14.5 tt . . . . . 0 C--O 1.236 0.371 0 N-CA-C 113.098 0.777 . . . . 2.1299999999999999 113.098 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 48.1 m -48.85 119.2 3.01 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.6 0.592 . . . . 1.29 112.6 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.85 1.45 67.75 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.946 -0.645 . . . . 0.0 114.408 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 507' ' ' ALA . . . . . 0.861 ' HB3' HG12 ' B' ' 504' ' ' ILE . . . -94.34 -7.59 41.31 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.646 0.723 . . . . 0.02 112.443 176.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 25.8 mmt -112.4 160.06 18.1 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 121.116 0.484 . . . . 2.21 112.283 174.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -69.76 134.26 48.38 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.085 -0.709 . . . . 2.6699999999999999 109.085 174.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 510' ' ' GLU . . . . . 0.606 ' HB2' HH21 ' B' ' 553' ' ' ARG . 39.7 tt0 -41.68 -35.47 0.78 Allowed 'General case' 0 C--O 1.24 0.598 0 N-CA-C 113.394 0.887 . . . . 2.6600000000000001 113.394 -173.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -73.73 -41.94 61.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.515 -0.766 . . . . 2.4399999999999999 112.117 -176.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -64.79 -40.16 94.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.178 0.513 . . . . 2.0800000000000001 110.878 171.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 513' ' ' GLU . . . . . 0.476 ' O ' HD13 ' B' ' 517' ' ' LEU . 45.0 tt0 -53.76 -48.62 69.56 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.344 -0.843 . . . . 1.9199999999999999 111.091 177.455 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 514' ' ' LYS . . . . . 0.416 ' O ' HG13 ' B' ' 518' ' ' VAL . 24.8 ttpp -54.9 -57.59 11.02 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 111.911 0.337 . . . . 2.73 111.911 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 515' ' ' ARG . . . . . 0.466 ' O ' HG22 ' B' ' 518' ' ' VAL . 37.1 ttm180 -56.6 -35.89 68.77 Favored 'General case' 0 CA--C 1.506 -0.733 0 O-C-N 124.209 0.943 . . . . 3.75 111.127 -177.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.498 ' O ' HG23 ' B' ' 520' ' ' VAL . 73.8 t80 -76.11 -45.58 33.11 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.065 -0.971 . . . . 1.8899999999999999 110.515 -173.415 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 517' ' ' LEU . . . . . 0.638 HD21 ' CG ' ' B' ' 551' ' ' TYR . 8.7 mp -66.73 -32.25 73.42 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.755 -0.657 . . . . 1.8999999999999999 112.642 177.151 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 518' ' ' VAL . . . . . 0.466 HG22 ' O ' ' B' ' 515' ' ' ARG . 28.3 m -67.49 -35.1 72.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 118.535 -1.266 . . . . 1.3999999999999999 109.07 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 20.7 p -72.99 -36.31 67.03 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.393 0.616 . . . . 1.1799999999999999 112.408 178.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 520' ' ' VAL . . . . . 0.498 HG23 ' O ' ' B' ' 516' ' ' PHE . 54.5 t -71.23 -42.29 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 122.133 -0.354 . . . . 1.22 111.703 -174.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 521' ' ' ILE . . . . . 0.515 ' O ' HD13 ' B' ' 525' ' ' LEU . 2.3 pp -90.68 -25.83 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.442 1.645 . . . . 1.98 115.442 -175.158 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 6.1 tmmm? -60.75 -35.24 75.89 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.712 -0.847 . . . . 2.5699999999999998 108.712 173.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -92.42 -21.53 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.979 1.474 . . . . 2.1699999999999999 114.979 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 38.4 mt -70.58 -45.43 65.37 Favored 'General case' 0 C--O 1.218 -0.588 0 N-CA-C 109.313 -0.625 . . . . 1.48 109.313 168.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 525' ' ' LEU . . . . . 0.635 HD12 HD13 ' B' ' 544' ' ' ILE . 7.5 mp -52.19 -45.43 65.15 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.197 0.522 . . . . 1.95 110.978 169.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 526' ' ' GLY . . . . . 0.455 ' O ' ' HG2' ' B' ' 529' ' ' GLU . . . -66.51 -40.63 94.33 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 -178.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 47.0 mt -63.52 -36.07 82.57 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 1.6699999999999999 111.47 175.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 528' ' ' CYS . . . . . 0.518 ' HB2' HG21 ' B' ' 540' ' ' ILE . 49.5 t -63.54 -47.7 80.55 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.08 -0.509 . . . . 0.58999999999999997 110.662 -175.269 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 529' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' B' ' 526' ' ' GLY . 13.0 pt-20 -61.8 -29.58 70.25 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.44 -0.8 . . . . 2.5 112.542 173.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -71.68 -54.64 9.67 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.376 0.88 . . . . 2.2400000000000002 113.376 -177.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 531' ' ' LYS . . . . . 0.46 ' O ' ' HD2' ' B' ' 537' ' ' LYS . 67.6 mttm -68.8 137.95 54.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.964 -0.562 . . . . 2.2799999999999998 111.119 -177.494 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -96.46 160.7 14.27 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.811 -0.631 . . . . 4.21 110.231 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.5 119.57 1.36 Allowed Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 115.905 -0.589 . . . . 0.0 114.019 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 534' ' ' LYS . . . . . 0.462 ' HD3' ' N ' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.11 -36.65 8.61 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.176 0.806 . . . . 2.9500000000000002 113.176 177.274 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -50.51 -51.92 43.22 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.382 -0.527 . . . . 2.2000000000000002 110.828 174.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 536' ' ' ASN . . . . . 0.479 ' O ' HD13 ' B' ' 540' ' ' ILE . 93.3 m-20 -65.98 -44.85 83.66 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.697 0.628 . . . . 1.47 112.697 178.265 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 537' ' ' LYS . . . . . 0.46 ' HD2' ' O ' ' B' ' 531' ' ' LYS . 0.0 OUTLIER -67.78 -31.97 72.23 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.375 -0.53 . . . . 2.5 110.368 -174.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.2 -46.95 69.21 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.79 -0.641 . . . . 0.040000000000000001 111.079 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 85.9 mt -58.1 -54.98 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.558 0.694 . . . . 1.8200000000000001 111.295 173.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 540' ' ' ILE . . . . . 0.518 HG21 ' HB2' ' B' ' 528' ' ' CYS . 1.7 mp -56.82 -48.04 81.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.719 -0.613 . . . . 1.8500000000000001 110.632 -178.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 541' ' ' ALA . . . . . 0.5 ' O ' ' HG2' ' B' ' 545' ' ' MET . . . -57.44 -44.21 84.55 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 113.514 0.931 . . . . 0.02 113.514 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 90.7 p -60.36 -38.78 84.94 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.601 -0.44 . . . . 1.2 110.271 -178.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 543' ' ' ASN . . . . . 0.442 ' O ' HG12 ' B' ' 547' ' ' ILE . 53.3 t30 -69.06 -47.06 66.28 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 114.362 1.245 . . . . 2.0299999999999998 114.362 -175.228 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 544' ' ' ILE . . . . . 0.635 HD13 HD12 ' B' ' 525' ' ' LEU . 23.1 mt -52.66 -45.89 48.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.539 -0.912 . . . . 1.8100000000000001 108.539 170.031 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 545' ' ' MET . . . . . 0.779 ' HB3' HG21 ' B' ' 587' ' ' THR . 33.4 mmt -64.05 -42.33 97.07 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 119.659 -0.816 . . . . 2.6000000000000001 112.833 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -58.28 -48.77 79.41 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 119.189 -1.004 . . . . 2.0800000000000001 109.893 176.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 547' ' ' ILE . . . . . 0.442 HG12 ' O ' ' B' ' 543' ' ' ASN . 43.3 mm -55.06 -61.48 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.77 0.656 . . . . 1.5 112.77 179.184 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 548' ' ' VAL . . . . . 0.718 HG13 HD11 ' B' ' 555' ' ' LEU . 97.9 t -47.3 -44.27 8.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 119.817 -0.753 . . . . 1.3999999999999999 111.427 176.278 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.02 58.81 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.791 -0.568 . . . . 0.0 112.934 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -87.05 -9.55 55.21 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.629 0.604 . . . . 2.27 112.629 -175.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 551' ' ' TYR . . . . . 0.638 ' CG ' HD21 ' B' ' 517' ' ' LEU . 84.7 m-85 -120.45 59.69 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.798 1.036 . . . . 3.5299999999999998 113.798 -176.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -55.97 -39.36 91.65 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 O-C-N 122.183 0.57 . . . . 0.46000000000000002 113.162 177.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 553' ' ' ARG . . . . . 0.606 HH21 ' HB2' ' B' ' 510' ' ' GLU . 11.2 ptm180 -56.33 -46.72 79.77 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 121.147 0.499 . . . . 3.8700000000000001 109.935 -174.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -48.96 -59.72 3.37 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.927 0.891 . . . . 0.69999999999999996 112.12 167.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 555' ' ' LEU . . . . . 0.718 HD11 HG13 ' B' ' 548' ' ' VAL . 11.1 mp -54.39 -48.49 71.49 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 116.305 -0.407 . . . . 1.49 110.177 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -53.94 -35.88 62.19 Favored 'General case' 0 C--O 1.242 0.682 0 N-CA-C 113.791 1.034 . . . . 3.0899999999999999 113.791 -178.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.1 -12.16 50.78 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.458 -0.497 . . . . 0.0 112.047 -177.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 17.4 t-160 -128.26 78.51 1.84 Allowed 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.456 1.28 . . . . 2.9300000000000002 114.456 -177.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -50.48 -48.26 56.76 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 116.584 2.068 . . . . 3.1099999999999999 116.584 -176.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 560' ' ' LYS . . . . . 0.426 ' O ' HG23 ' B' ' 564' ' ' THR . 4.7 tppp? -56.71 -36.65 69.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.325 -0.398 . . . . 3.3199999999999998 111.099 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 561' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -74.84 -45.14 45.21 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.095 -1.042 . . . . 1.25 111.916 175.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 562' ' ' LEU . . . . . 0.557 ' O ' HG12 ' B' ' 565' ' ' VAL . 6.3 tt -49.99 -59.15 4.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.529 0.332 . . . . 1.3200000000000001 110.226 175.087 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -50.21 -38.54 40.71 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.912 1.079 . . . . 2.7400000000000002 113.912 178.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 564' ' ' THR . . . . . 0.556 ' HB ' HD12 ' A' ' 14' ' ' LEU . 24.0 p -71.92 -39.31 69.56 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.498 0.666 . . . . 1.24 110.371 -176.099 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 565' ' ' VAL . . . . . 0.689 HG21 HG11 ' B' ' 548' ' ' VAL . 0.3 OUTLIER -62.83 -41.24 91.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.676 -0.693 . . . . 1.1899999999999999 112.543 173.361 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 566' ' ' VAL . . . . . . . . . . . . . 85.2 t -71.11 -50.83 39.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 C-N-CA 120.519 -0.473 . . . . 1.3600000000000001 110.845 -176.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 15.1 m-80 -51.09 -37.42 45.63 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.965 -0.562 . . . . 1.9399999999999999 112.01 170.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 36.1 mmtm -72.58 -32.76 66.26 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.701 -0.481 . . . . 3.5299999999999998 109.701 -179.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 569' ' ' LEU . . . . . 0.432 HD13 ' O ' ' B' ' 565' ' ' VAL . 4.3 mp -67.45 -36.51 81.34 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 108.737 -0.838 . . . . 2.0099999999999998 108.737 177.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 570' ' ' PHE . . . . . 0.602 ' HA ' HD11 ' B' ' 621' ' ' ILE . 18.2 m-30 -65.29 -39.35 92.41 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.915 -0.402 . . . . 3.77 109.915 178.284 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.448 ' O ' ' ND1' ' B' ' 574' ' ' HIS . 36.8 tt0 -57.74 -53.44 58.16 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 119.921 -0.711 . . . . 2.4700000000000002 110.508 176.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -62.43 -10.0 10.15 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.11 1.152 . . . . 1.23 114.11 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 573' ' ' MET . . . . . 0.5 ' HB3' HD21 ' B' ' 625' ' ' LEU . 54.9 mtt -76.4 -5.31 46.73 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.703 0.763 . . . . 2.1099999999999999 109.646 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 574' ' ' HIS . . . . . 0.448 ' ND1' ' O ' ' B' ' 571' ' ' GLU . 0.0 OUTLIER -109.48 -0.51 18.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.729 -1.123 . . . . 3.2000000000000002 111.434 173.792 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 575' ' ' GLU . . . . . 0.411 ' HG2' HG11 ' B' ' 580' ' ' VAL . 9.7 tp10 -68.51 130.18 42.11 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 116.217 -0.447 . . . . 1.55 110.094 177.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 3.9 t -87.79 -21.31 25.18 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.984 0.735 . . . . 1.3999999999999999 112.984 -177.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 577' ' ' HIS . . . . . 0.417 ' HE1' ' HB2' ' A' ' 20' ' ' ASN . 30.2 m80 -60.11 128.03 34.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.385 0.612 . . . . 2.8500000000000001 112.597 -175.379 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -44.92 125.84 5.39 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.372 -0.831 . . . . 2.1499999999999999 113.132 -171.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.3 -34.74 4.77 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.203 1.241 . . . . 0.0 116.203 174.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 580' ' ' VAL . . . . . 0.411 HG11 ' HG2' ' B' ' 575' ' ' GLU . 47.5 t -53.67 -46.36 61.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.195 0.813 . . . . 1.29 113.195 -175.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 22.2 pt20 -59.72 -42.22 92.6 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.406 0.521 . . . . 1.99 112.406 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.54 -42.43 96.52 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.155 0.428 . . . . 2.23 112.155 172.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 90.8 mmm -60.72 -49.46 77.41 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.069 -0.252 . . . . 2.5800000000000001 110.43 175.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.78 -43.0 80.41 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.154 -0.475 . . . . 0.029999999999999999 111.664 -177.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 585' ' ' CYS . . . . . 0.434 ' O ' HG12 ' B' ' 589' ' ' ILE . 52.7 t -74.38 -40.99 61.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 120.042 -0.663 . . . . 1.5 111.912 -177.246 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -59.58 -46.34 89.21 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.316 -0.402 . . . . 1.98 111.95 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 587' ' ' THR . . . . . 0.779 HG21 ' HB3' ' B' ' 545' ' ' MET . 36.4 p -62.15 -41.26 98.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.3 110.366 175.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -61.41 -32.25 72.19 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.147 -0.478 . . . . 0.53000000000000003 111.129 -177.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 589' ' ' ILE . . . . . 0.434 HG12 ' O ' ' B' ' 585' ' ' CYS . 50.3 mm -79.88 -36.02 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 C-N-CA 116.902 -1.919 . . . . 1.97 109.775 -175.339 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 590' ' ' LYS . . . . . 0.403 ' NZ ' ' HA ' ' B' ' 587' ' ' THR . 36.8 mtmm -57.4 -50.01 74.35 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 107.75 -1.204 . . . . 2.6200000000000001 107.75 176.098 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 83.9 mt -63.84 -43.76 97.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.697 -0.683 . . . . 1.96 112.726 -176.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.96 -39.1 93.37 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.425 -0.51 . . . . 0.0 112.285 177.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -62.38 -70.04 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 119.096 -1.041 . . . . 2.3599999999999999 109.815 174.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -56.16 -23.72 36.66 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 116.596 2.073 . . . . 2.1899999999999999 116.596 -176.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 82.8 m -121.71 25.14 9.42 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 114.241 1.2 . . . . 1.26 114.241 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -48.52 -38.47 20.4 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.835 1.791 . . . . 3.5800000000000001 115.835 -172.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -69.7 -32.54 71.19 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.212 0.819 . . . . 3.7400000000000002 113.212 -175.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 55.3 m80 -70.16 -3.77 18.36 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.593 -0.731 . . . . 2.1400000000000001 112.08 -173.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -105.53 -17.01 14.55 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.564 0.54 . . . . 2.9500000000000002 110.241 -176.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 21.6 t -105.82 -24.37 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.025 -0.989 . . . . 1.4199999999999999 111.327 -175.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -101.97 139.49 37.53 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 119.566 -0.854 . . . . 2.3399999999999999 111.576 176.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 11.8 m -60.85 122.69 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.671 -0.863 . . . . 1.3700000000000001 108.671 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -92.75 167.3 11.97 Favored 'General case' 0 C--O 1.225 -0.213 0 O-C-N 123.659 0.599 . . . . 2.6800000000000002 110.111 -177.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 34.9 t -71.94 128.96 35.47 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 N-CA-C 112.949 0.722 . . . . 1.27 112.949 -175.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.33 6.59 64.42 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.11 -175.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -131.53 157.99 42.12 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.565 -0.854 . . . . 2.5099999999999998 110.745 175.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 29.2 t -103.2 -22.62 4.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.029 -0.987 . . . . 1.3999999999999999 112.496 -175.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 608' ' ' MET . . . . . . . . . . . . . 66.0 mtm -136.91 142.25 37.87 Favored Pre-proline 0 C--O 1.223 -0.302 0 N-CA-C 112.626 0.602 . . . . 2.6800000000000002 112.626 -174.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 609' ' ' PRO . . . . . 0.543 ' HB2' HG22 ' B' ' 611' ' ' ILE . 9.6 Cg_endo -52.08 130.88 36.85 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.845 1.03 . . . . 0.42999999999999999 112.131 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -57.02 -31.79 65.49 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.826 0.306 . . . . 2.3700000000000001 111.826 -174.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 611' ' ' ILE . . . . . 0.543 HG22 ' HB2' ' B' ' 609' ' ' PRO . 5.9 tp -50.1 -44.74 22.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 120.782 0.325 . . . . 1.8400000000000001 110.577 178.23 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 612' ' ' ASP . . . . . 0.411 ' N ' HG23 ' B' ' 611' ' ' ILE . 16.7 t70 -49.9 -52.12 35.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.632 0.773 . . . . 2.1499999999999999 112.855 177.612 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 613' ' ' GLU . . . . . 0.553 ' HA ' ' ND2' ' B' ' 616' ' ' ASN . 45.7 mt-10 -59.86 -37.03 78.16 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 120.512 -0.475 . . . . 2.6600000000000001 110.231 179.493 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 62.1 mt -64.58 -48.03 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 120.149 -0.62 . . . . 1.76 111.907 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.63 -31.13 71.93 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.959 0.725 . . . . 1.8400000000000001 112.959 -177.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 616' ' ' ASN . . . . . 0.553 ' ND2' ' HA ' ' B' ' 613' ' ' GLU . 20.6 p30 -79.57 2.15 23.33 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.559 1.318 . . . . 2.0600000000000001 114.559 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -142.43 15.67 2.02 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 113.114 0.783 . . . . 1.97 113.114 -174.229 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 618' ' ' ILE . . . . . 0.542 ' O ' HG22 ' B' ' 621' ' ' ILE . 5.0 tp -46.95 -47.01 8.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 C-N-CA 118.973 -1.091 . . . . 2.0099999999999998 110.135 -176.66 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 619' ' ' ASN . . . . . 0.426 ' N ' HG23 ' B' ' 618' ' ' ILE . 41.5 t-20 -63.23 -51.07 67.72 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 113.749 1.018 . . . . 2.2799999999999998 113.749 -176.345 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 72.6 p -56.9 -31.93 65.39 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.455 -0.898 . . . . 1.3200000000000001 110.737 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 621' ' ' ILE . . . . . 0.602 HD11 ' HA ' ' B' ' 570' ' ' PHE . 0.4 OUTLIER -79.32 -42.54 23.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 115.362 1.615 . . . . 2.0 115.362 -178.982 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 622' ' ' ILE . . . . . 0.409 HG12 ' O ' ' B' ' 618' ' ' ILE . 37.6 pt -87.73 -6.27 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.037 1.495 . . . . 2.0899999999999999 115.037 -177.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 54.0 t -19.9 -58.33 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 116.642 2.09 . . . . 1.47 116.642 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -99.29 -7.56 26.18 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.028 -1.442 . . . . 2.0699999999999998 110.989 -163.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 625' ' ' LEU . . . . . 0.5 HD21 ' HB3' ' B' ' 573' ' ' MET . 93.7 mt -71.94 146.93 47.46 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.295 0.372 . . . . 1.6699999999999999 111.694 -173.623 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 626' ' ' GLN . . . . . 0.714 ' O ' HG13 ' B' ' 630' ' ' VAL . 17.3 mp0 -76.74 162.1 71.65 Favored Pre-proline 0 N--CA 1.463 0.189 0 N-CA-C 108.776 -0.824 . . . . 2.3500000000000001 108.776 174.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 627' ' ' PRO . . . . . 0.757 ' O ' HG22 ' B' ' 630' ' ' VAL . 79.4 Cg_exo -47.81 -43.56 28.89 Favored 'Trans proline' 0 CA--C 1.529 0.243 0 N-CA-C 115.856 1.445 . . . . 0.44 115.856 -178.458 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -67.36 -43.02 82.47 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.608 -0.516 . . . . 2.6200000000000001 109.608 -174.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -63.28 -38.33 90.72 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.929 -0.578 . . . . 2.0600000000000001 110.831 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 630' ' ' VAL . . . . . 0.757 HG22 ' O ' ' B' ' 627' ' ' PRO . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.353 -0.832 . . . . 1.3 110.661 176.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.163 0 N-CA-C 112.429 -0.269 . . . . 9.8599999999999994 112.429 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.3 t 58.28 21.62 8.4 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.076 0.465 . . . . 8.7799999999999994 110.783 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -76.2 -27.47 56.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.921 -0.581 . . . . 6.8200000000000003 111.081 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.2 t -167.47 -74.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 6.25 110.848 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 76.96 37.3 33.5 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.617 -0.801 . . . . 4.1200000000000001 112.505 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.443 ' O ' ' HG2' ' A' ' 9' ' ' GLU . 18.9 m120 -148.97 -28.36 0.28 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.984 0.421 . . . . 4.0300000000000002 110.456 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.466 ' HG ' HD12 ' A' ' 10' ' ' LEU . 4.8 tt -81.24 -14.85 57.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.906 -0.588 . . . . 2.21 111.356 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -61.65 -35.69 78.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.406 -0.361 . . . . 3.79 111.852 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 6' ' ' ASN . 12.2 pt-20 -73.94 -24.28 59.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.682 0.277 . . . . 4.1699999999999999 111.355 -179.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.466 HD12 ' HG ' ' A' ' 7' ' ' LEU . 25.0 mt -67.49 -21.06 65.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.403 -0.362 . . . . 2.5800000000000001 111.086 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.23 -35.88 35.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 2.8399999999999999 111.806 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 48.2 tp -60.5 -30.21 69.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.417 -0.356 . . . . 3.6699999999999999 111.163 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.45 ' O ' HD11 ' B' ' 525' ' ' LEU . 1.4 mptm? -76.62 -34.08 58.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 4.9299999999999997 111.465 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.633 HD12 HG22 ' B' ' 564' ' ' THR . 2.6 tm? -59.36 -44.34 92.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.505 -0.316 . . . . 3.27 110.831 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.02 -9.5 4.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.311 -0.404 . . . . 3.1299999999999999 111.536 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -101.24 49.83 1.03 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.813 -0.708 . . . . 2.4700000000000002 112.719 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.538 HD12 ' HZ ' ' B' ' 572' ' ' PHE . 0.2 OUTLIER -117.41 105.5 12.2 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 110.245 -0.28 . . . . 2.1400000000000001 110.245 -179.986 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -129.22 134.78 48.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.885 0.374 . . . . 3.9199999999999999 111.21 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.555 HG23 ' HB2' ' B' ' 537' ' ' LYS . 75.5 mt -90.32 -29.1 4.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 3.25 110.857 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 60.7 m-20 -62.53 -74.08 0.1 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.199 -0.455 . . . . 5.9500000000000002 111.057 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -171.01 -158.19 0.14 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 9.3900000000000006 110.902 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.1 m 66.65 125.89 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.052 0.453 . . . . 8.9700000000000006 111.333 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -145.32 160.8 40.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.98 -0.554 . . . . 11.67 110.697 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -138.25 103.21 0.4 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.623 -0.799 . . . . 12.859999999999999 112.588 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -123.28 121.72 36.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.653 0.263 . . . . 15.369999999999999 110.823 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -101.56 139.64 36.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.328 -0.396 . . . . 16.539999999999999 111.003 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 82.3 m . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.158 -0.925 . . . . 17.93 110.707 179.86 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 504' ' ' ILE . . . . . 0.937 HG13 ' HB3' ' B' ' 507' ' ' ALA . 7.6 tp . . . . . 0 C--O 1.235 0.309 0 N-CA-C 113.076 0.769 . . . . 2.1299999999999999 113.076 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 80.0 p -48.91 119.12 2.97 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.53 0.567 . . . . 1.29 112.53 174.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.9 1.39 67.67 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 120.964 -0.636 . . . . 0.0 114.37 -179.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 507' ' ' ALA . . . . . 0.937 ' HB3' HG13 ' B' ' 504' ' ' ILE . . . -94.29 -7.56 41.57 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 117.736 0.768 . . . . 0.02 112.405 176.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -112.49 160.02 18.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.191 0.519 . . . . 2.21 112.186 174.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -69.78 134.14 48.23 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.131 -0.692 . . . . 2.6699999999999999 109.131 174.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -41.57 -35.46 0.73 Allowed 'General case' 0 C--O 1.24 0.567 0 N-CA-C 113.421 0.897 . . . . 2.6600000000000001 113.421 -173.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.78 -41.96 61.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.505 -0.771 . . . . 2.4399999999999999 112.082 -176.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.87 -40.04 94.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.133 0.492 . . . . 2.0800000000000001 110.893 171.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -53.66 -48.76 69.12 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.387 -0.824 . . . . 1.9199999999999999 111.102 177.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 514' ' ' LYS . . . . . 0.46 ' O ' HG23 ' B' ' 518' ' ' VAL . 7.3 mtpm? -54.77 -57.67 10.62 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 111.869 0.322 . . . . 2.73 111.869 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 515' ' ' ARG . . . . . 0.403 ' O ' HG23 ' B' ' 519' ' ' THR . 61.3 ttp180 -56.59 -35.96 68.82 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.173 0.921 . . . . 3.75 111.086 -177.478 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.571 ' O ' HG23 ' B' ' 520' ' ' VAL . 62.5 t80 -76.09 -45.6 33.16 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.159 -0.928 . . . . 1.8899999999999999 110.514 -173.358 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 517' ' ' LEU . . . . . 0.417 ' O ' HG22 ' B' ' 521' ' ' ILE . 13.7 tp -66.74 -32.25 73.43 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.731 -0.668 . . . . 1.8999999999999999 112.615 177.139 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 518' ' ' VAL . . . . . 0.515 ' O ' ' HB2' ' B' ' 522' ' ' LYS . 69.3 t -67.5 -35.13 72.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 118.58 -1.248 . . . . 1.3999999999999999 109.081 178.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 519' ' ' THR . . . . . 0.403 HG23 ' O ' ' B' ' 515' ' ' ARG . 74.1 p -72.94 -36.37 67.19 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.1799999999999999 112.413 178.473 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 520' ' ' VAL . . . . . 0.571 HG23 ' O ' ' B' ' 516' ' ' PHE . 67.0 t -71.14 -42.45 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 116.46 -0.336 . . . . 1.22 111.638 -174.447 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 521' ' ' ILE . . . . . 0.417 HG22 ' O ' ' B' ' 517' ' ' LEU . 17.6 tt -90.65 -25.78 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 115.406 1.632 . . . . 1.98 115.406 -175.028 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 522' ' ' LYS . . . . . 0.515 ' HB2' ' O ' ' B' ' 518' ' ' VAL . 0.3 OUTLIER -60.92 -35.25 76.2 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.599 -0.889 . . . . 2.5699999999999998 108.599 173.6 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -92.4 -21.35 20.27 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.062 1.504 . . . . 2.1699999999999999 115.062 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 68.5 mt -70.64 -45.38 65.26 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.3 -0.63 . . . . 1.48 109.3 168.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 525' ' ' LEU . . . . . 0.471 HD12 HD23 ' A' ' 17' ' ' LEU . 0.6 OUTLIER -52.31 -45.4 65.56 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.2 0.524 . . . . 1.95 110.931 169.778 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.55 -40.47 94.22 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 40.2 mt -63.63 -36.14 82.84 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.043 0.449 . . . . 1.6699999999999999 111.426 175.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 48.1 t -63.47 -47.74 80.54 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.041 -0.527 . . . . 0.58999999999999997 110.648 -175.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -61.8 -29.52 70.21 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.472 -0.786 . . . . 2.5 112.517 173.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -71.71 -54.65 9.61 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.353 0.872 . . . . 2.2400000000000002 113.353 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -68.76 137.94 54.44 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.008 -0.542 . . . . 2.2799999999999998 111.07 -177.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 532' ' ' ARG . . . . . 0.438 ' HA ' ' NZ ' ' B' ' 537' ' ' LYS . 35.8 mmt180 -96.44 160.67 14.28 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.774 -0.648 . . . . 4.21 110.183 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.44 119.67 1.36 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.984 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 534' ' ' LYS . . . . . 0.691 ' H ' ' HD2' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.18 -36.64 8.92 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.207 0.817 . . . . 2.9500000000000002 113.207 177.245 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -50.5 -51.85 43.66 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.413 -0.515 . . . . 2.2000000000000002 110.828 174.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -66.09 -44.85 83.21 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.62 0.6 . . . . 1.47 112.62 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 537' ' ' LYS . . . . . 0.555 ' HB2' HG23 ' A' ' 19' ' ' ILE . 64.6 mttp -67.87 -31.98 72.16 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.272 -174.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.09 -46.99 69.45 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.839 -0.619 . . . . 0.040000000000000001 111.115 178.416 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 75.8 mt -58.12 -55.03 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 121.569 0.699 . . . . 1.8200000000000001 111.194 173.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 540' ' ' ILE . . . . . . . . . . . . . 94.0 mt -56.81 -48.07 81.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.605 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 541' ' ' ALA . . . . . 0.451 ' O ' HG12 ' B' ' 544' ' ' ILE . . . -57.49 -43.99 84.6 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 113.583 0.957 . . . . 0.02 113.583 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 94.8 p -60.46 -38.86 85.54 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.647 -0.421 . . . . 1.2 110.215 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 543' ' ' ASN . . . . . 0.469 ' O ' HG12 ' B' ' 547' ' ' ILE . 49.5 t30 -69.05 -47.05 66.35 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 114.352 1.241 . . . . 2.0299999999999998 114.352 -175.174 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 544' ' ' ILE . . . . . 0.476 HG13 ' N ' ' B' ' 545' ' ' MET . 48.9 pt -52.63 -45.94 48.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.492 -0.929 . . . . 1.8100000000000001 108.492 170.032 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 545' ' ' MET . . . . . 0.476 ' N ' HG13 ' B' ' 544' ' ' ILE . 21.4 mmt -64.03 -42.33 97.12 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.729 -0.788 . . . . 2.6000000000000001 112.818 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -58.3 -48.78 79.41 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 119.181 -1.007 . . . . 2.0800000000000001 109.887 176.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 547' ' ' ILE . . . . . 0.469 HG12 ' O ' ' B' ' 543' ' ' ASN . 42.0 mm -55.06 -61.38 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.823 0.675 . . . . 1.5 112.823 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 548' ' ' VAL . . . . . 0.445 HG22 ' HA ' ' B' ' 545' ' ' MET . 36.0 m -47.44 -44.23 9.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 C-N-CA 119.854 -0.738 . . . . 1.3999999999999999 111.388 176.268 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.03 58.82 Favored Glycine 0 C--O 1.237 0.336 0 O-C-N 121.791 -0.568 . . . . 0.0 112.917 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 550' ' ' GLN . . . . . 0.402 ' O ' ' HG3' ' B' ' 550' ' ' GLN . 6.7 tp60 -87.04 -9.58 55.14 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 112.629 0.604 . . . . 2.27 112.629 -175.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 551' ' ' TYR . . . . . 0.427 ' O ' HD13 ' B' ' 555' ' ' LEU . 64.4 m-85 -120.38 59.63 6.95 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 113.857 1.058 . . . . 3.5299999999999998 113.857 -176.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 552' ' ' PRO . . . . . 0.568 ' HG3' ' HG2' ' B' ' 594' ' ' LYS . 15.4 Cg_endo -55.99 -39.35 91.72 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.122 0.538 . . . . 0.46000000000000002 113.115 178.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 22.0 tpp180 -56.3 -46.81 79.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.134 0.492 . . . . 3.8700000000000001 109.859 -174.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 554' ' ' PHE . . . . . 0.484 ' HD2' HD12 ' B' ' 555' ' ' LEU . 67.8 t80 -48.88 -59.81 3.27 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.935 0.894 . . . . 0.69999999999999996 112.098 168.014 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 555' ' ' LEU . . . . . 0.484 HD12 ' HD2' ' B' ' 554' ' ' PHE . 8.2 mp -54.26 -48.62 70.96 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.303 -0.408 . . . . 1.49 110.219 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -53.83 -35.91 61.96 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.831 1.049 . . . . 3.0899999999999999 113.831 -178.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.03 -12.25 50.76 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.517 -0.473 . . . . 0.0 112.088 -177.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -128.18 78.5 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 2.9300000000000002 114.388 -177.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 22.0 m-90 -50.52 -48.32 57.18 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 116.534 2.05 . . . . 3.1099999999999999 116.534 -176.056 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 560' ' ' LYS . . . . . 0.514 ' HA ' ' HE3' ' B' ' 563' ' ' LYS . 37.8 mtmm -56.48 -36.66 69.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.324 -0.398 . . . . 3.3199999999999998 111.213 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 561' ' ' PHE . . . . . 0.436 ' O ' HG23 ' B' ' 565' ' ' VAL . 0.7 OUTLIER -74.95 -45.07 44.81 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 119.142 -1.023 . . . . 1.25 111.871 175.613 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 562' ' ' LEU . . . . . 0.512 ' O ' HG23 ' B' ' 566' ' ' VAL . 3.9 tp -50.01 -59.15 4.17 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.509 0.324 . . . . 1.3200000000000001 110.258 175.09 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 563' ' ' LYS . . . . . 0.514 ' HE3' ' HA ' ' B' ' 560' ' ' LYS . 19.6 pttp -50.18 -38.66 40.81 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.896 1.073 . . . . 2.7400000000000002 113.896 178.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 564' ' ' THR . . . . . 0.633 HG22 HD12 ' A' ' 14' ' ' LEU . 62.4 m -71.74 -39.39 70.1 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.562 0.696 . . . . 1.24 110.413 -176.129 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 565' ' ' VAL . . . . . 0.436 HG23 ' O ' ' B' ' 561' ' ' PHE . 92.2 t -62.84 -41.34 92.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.646 -0.706 . . . . 1.1899999999999999 112.527 173.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 566' ' ' VAL . . . . . 0.512 HG23 ' O ' ' B' ' 562' ' ' LEU . 36.2 t -70.93 -50.85 40.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 120.551 -0.46 . . . . 1.3600000000000001 110.924 -176.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -51.11 -37.38 45.67 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.03 -0.532 . . . . 1.9399999999999999 111.987 170.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 568' ' ' LYS . . . . . 0.477 ' HZ3' ' HB2' ' B' ' 568' ' ' LYS . 0.6 OUTLIER -72.72 -32.68 65.89 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.599 -0.519 . . . . 3.5299999999999998 109.599 -179.117 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 569' ' ' LEU . . . . . 0.443 HD23 ' HB2' ' B' ' 588' ' ' PHE . 3.4 mp -67.53 -36.42 80.97 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 108.712 -0.847 . . . . 2.0099999999999998 108.712 177.139 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -65.34 -39.39 92.33 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.899 -0.408 . . . . 3.77 109.899 178.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -57.67 -53.46 57.94 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 120.036 -0.665 . . . . 2.4700000000000002 110.521 176.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 572' ' ' PHE . . . . . 0.538 ' HZ ' HD12 ' A' ' 17' ' ' LEU . 42.0 m-85 -62.57 -9.91 10.36 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.018 1.118 . . . . 1.23 114.018 -177.178 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 573' ' ' MET . . . . . 0.417 ' HG3' ' O ' ' B' ' 569' ' ' LEU . 65.6 mtt -76.36 -5.29 46.56 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.671 0.748 . . . . 2.1099999999999999 109.7 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -109.43 -0.54 18.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.73 -1.123 . . . . 3.2000000000000002 111.465 173.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 575' ' ' GLU . . . . . 0.542 ' CG ' HG11 ' B' ' 580' ' ' VAL . 7.2 tp10 -68.59 130.28 42.38 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.189 -0.46 . . . . 1.55 110.104 177.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 62.2 p -87.92 -21.27 25.03 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 113.006 0.743 . . . . 1.3999999999999999 113.006 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 577' ' ' HIS . . . . . 0.773 ' O ' HG12 ' B' ' 580' ' ' VAL . 10.7 t60 -60.2 128.02 34.72 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.418 0.628 . . . . 2.8500000000000001 112.545 -175.375 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -44.83 125.87 5.32 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.38 -0.827 . . . . 2.1499999999999999 113.135 -171.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.23 -34.74 4.75 Favored Glycine 0 C--O 1.223 -0.57 0 N-CA-C 116.254 1.262 . . . . 0.0 116.254 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 580' ' ' VAL . . . . . 0.773 HG12 ' O ' ' B' ' 577' ' ' HIS . 13.6 p -53.82 -46.34 63.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 113.121 0.785 . . . . 1.29 113.121 -175.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.524 ' N ' HG13 ' B' ' 580' ' ' VAL . 0.7 OUTLIER -59.67 -42.21 92.37 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.406 0.521 . . . . 1.99 112.406 -179.852 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 582' ' ' ASP . . . . . 0.65 ' HA ' ' NE2' ' B' ' 629' ' ' GLN . 19.3 t70 -60.54 -42.5 96.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.149 0.425 . . . . 2.23 112.149 172.098 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 31.8 mmt -60.66 -49.49 77.29 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 121.109 -0.236 . . . . 2.5800000000000001 110.439 175.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.87 -42.87 80.54 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.176 -0.465 . . . . 0.029999999999999999 111.74 -177.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 44.4 t -74.43 -40.92 61.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 120.009 -0.676 . . . . 1.5 111.957 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.58 -46.31 89.3 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.306 -0.406 . . . . 1.98 111.95 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 41.0 m -62.15 -41.25 98.11 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.329 0.652 . . . . 1.3 110.413 175.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 588' ' ' PHE . . . . . 0.443 ' HB2' HD23 ' B' ' 569' ' ' LEU . 87.0 t80 -61.52 -32.15 72.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.007 -0.542 . . . . 0.53000000000000003 111.125 -177.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 589' ' ' ILE . . . . . . . . . . . . . 47.4 mm -79.86 -36.0 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.871 -1.932 . . . . 1.97 109.8 -175.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -57.44 -50.01 74.39 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 107.713 -1.218 . . . . 2.6200000000000001 107.713 176.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 98.2 mt -63.82 -43.82 98.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 112.786 0.661 . . . . 1.96 112.786 -177.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.83 -39.14 93.52 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 177.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -62.32 -70.14 0.22 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.155 -1.018 . . . . 2.3599999999999999 109.772 174.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 594' ' ' LYS . . . . . 0.568 ' HG2' ' HG3' ' B' ' 552' ' ' PRO . 2.3 mppt? -56.11 -23.84 36.81 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.562 2.06 . . . . 2.1899999999999999 116.562 -176.478 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 83.6 m -121.67 25.22 9.4 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.263 1.209 . . . . 1.26 114.263 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 596' ' ' ARG . . . . . 0.517 ' HA ' ' CE2' ' B' ' 599' ' ' PHE . 34.4 ptt180 -48.52 -38.54 20.57 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.83 1.789 . . . . 3.5800000000000001 115.83 -172.447 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 68.7 mtm180 -69.52 -32.61 71.56 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.214 0.82 . . . . 3.7400000000000002 113.214 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -3.81 18.68 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.577 -0.738 . . . . 2.1400000000000001 112.052 -173.558 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 599' ' ' PHE . . . . . 0.524 ' C ' ' HD1' ' B' ' 599' ' ' PHE . 0.1 OUTLIER -105.62 -16.89 14.57 Favored 'General case' 0 CA--C 1.517 -0.32 0 O-C-N 123.621 0.576 . . . . 2.9500000000000002 110.158 -176.552 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 600' ' ' VAL . . . . . 0.46 ' N ' ' HD1' ' B' ' 599' ' ' PHE . 9.4 p -105.82 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.162 -0.926 . . . . 1.4199999999999999 111.327 -175.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -102.04 139.52 37.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 119.551 -0.86 . . . . 2.3399999999999999 111.596 176.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 3.9 p -60.89 122.74 12.14 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 108.597 -0.89 . . . . 1.3700000000000001 108.597 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -92.76 167.3 11.97 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 123.675 0.609 . . . . 2.6800000000000002 110.086 -177.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 7.4 p -71.94 129.01 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 N-CA-C 112.927 0.714 . . . . 1.27 112.927 -175.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.31 6.53 64.51 Favored Glycine 0 N--CA 1.446 -0.7 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.111 -175.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 606' ' ' GLU . . . . . 0.523 ' HG3' ' H ' ' B' ' 608' ' ' MET . 8.3 tp10 -131.5 158.0 42.04 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.557 -0.857 . . . . 2.5099999999999998 110.746 175.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 16.7 t -103.27 -22.55 4.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.032 -0.985 . . . . 1.3999999999999999 112.451 -175.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 608' ' ' MET . . . . . 0.523 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 88.2 mtp -136.95 142.28 37.94 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.672 0.619 . . . . 2.6800000000000002 112.672 -174.281 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -52.08 130.88 36.86 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.42999999999999999 112.131 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -57.02 -31.76 65.46 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.826 0.306 . . . . 2.3700000000000001 111.826 -174.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 611' ' ' ILE . . . . . 0.518 HG12 ' O ' ' B' ' 599' ' ' PHE . 6.4 pt -50.05 -44.87 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 120.784 0.326 . . . . 1.8400000000000001 110.513 178.217 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 612' ' ' ASP . . . . . 0.436 ' H ' HG13 ' B' ' 611' ' ' ILE . 24.8 m-20 -49.94 -52.01 36.69 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.621 0.769 . . . . 2.1499999999999999 112.844 177.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -59.94 -37.14 78.65 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.613 -0.435 . . . . 2.6600000000000001 110.175 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 65.2 mt -64.51 -48.02 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.214 -0.594 . . . . 1.76 111.961 178.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 615' ' ' LEU . . . . . 0.597 HD13 HD11 ' B' ' 618' ' ' ILE . 4.5 mm? -62.63 -31.11 71.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.958 0.725 . . . . 1.8400000000000001 112.958 -177.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -79.54 2.14 23.3 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.662 1.356 . . . . 2.0600000000000001 114.662 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -142.42 15.61 2.02 Favored 'General case' 0 C--O 1.243 0.72 0 N-CA-C 113.152 0.797 . . . . 1.97 113.152 -174.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 618' ' ' ILE . . . . . 0.597 HD11 HD13 ' B' ' 615' ' ' LEU . 72.0 mt -46.83 -47.14 8.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 118.997 -1.081 . . . . 2.0099999999999998 110.176 -176.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 619' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -63.09 -51.14 67.79 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.744 1.016 . . . . 2.2799999999999998 113.744 -176.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 32.6 m -56.92 -31.87 65.38 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 119.487 -0.885 . . . . 1.3200000000000001 110.743 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 621' ' ' ILE . . . . . . . . . . . . . 64.6 mt -79.32 -42.7 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 115.334 1.605 . . . . 2.0 115.334 -178.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 622' ' ' ILE . . . . . 0.4 HG12 ' O ' ' B' ' 618' ' ' ILE . 47.2 pt -87.5 -6.48 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 115.059 1.503 . . . . 2.0899999999999999 115.059 -177.669 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 8.7 p -19.91 -58.3 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.575 2.065 . . . . 1.47 116.575 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -99.26 -7.57 26.23 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 114.045 -1.434 . . . . 2.0699999999999998 111.043 -163.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 625' ' ' LEU . . . . . . . . . . . . . 96.0 mt -71.93 146.9 47.51 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 123.286 0.366 . . . . 1.6699999999999999 111.601 -173.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 626' ' ' GLN . . . . . 0.438 ' O ' HG23 ' B' ' 630' ' ' VAL . 1.9 mp0 -76.74 162.09 71.7 Favored Pre-proline 0 CA--C 1.52 -0.191 0 N-CA-C 108.835 -0.802 . . . . 2.3500000000000001 108.835 174.686 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -47.85 -43.58 29.09 Favored 'Trans proline' 0 C--O 1.233 0.256 0 N-CA-C 115.765 1.409 . . . . 0.44 115.765 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -67.33 -42.98 82.67 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.637 -0.505 . . . . 2.6200000000000001 109.637 -174.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 629' ' ' GLN . . . . . 0.65 ' NE2' ' HA ' ' B' ' 582' ' ' ASP . 12.7 mm100 -63.31 -38.23 90.35 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.924 -0.58 . . . . 2.0600000000000001 110.924 178.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 630' ' ' VAL . . . . . 0.438 HG23 ' O ' ' B' ' 626' ' ' GLN . 95.1 t . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.315 -0.85 . . . . 1.3 110.685 176.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 112.36 -0.296 . . . . 9.8599999999999994 112.36 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.8 m -135.91 38.42 2.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.837 0.351 . . . . 8.7799999999999994 110.875 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 58.76 27.45 16.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.08 -0.509 . . . . 6.8200000000000003 111.237 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.5 t -96.24 137.97 34.54 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.186 -0.461 . . . . 6.25 111.189 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 103.06 116.76 4.24 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.94 -0.648 . . . . 4.1200000000000001 112.599 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -149.59 -49.03 0.14 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.651 0.262 . . . . 4.0300000000000002 110.711 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.661 HD21 ' HE2' ' B' ' 514' ' ' LYS . 3.9 mm? -55.56 -30.43 60.77 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.387 -0.37 . . . . 2.21 110.991 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -62.06 -34.77 76.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.299 -0.41 . . . . 3.79 110.906 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -76.6 -33.12 58.44 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.179 -0.464 . . . . 4.1699999999999999 110.872 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.78 HD21 HG23 ' B' ' 518' ' ' VAL . 10.4 mp -56.5 -35.38 67.94 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.997 0.427 . . . . 2.5800000000000001 110.633 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.97 -34.36 38.73 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.012 -0.54 . . . . 2.8399999999999999 110.809 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.4 tp -69.33 -19.71 63.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.923 -0.581 . . . . 3.6699999999999999 110.413 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 52.0 tptt -80.35 -21.11 42.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.93 -0.577 . . . . 4.9299999999999997 111.068 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.514 HD21 ' HD3' ' B' ' 568' ' ' LYS . 0.7 OUTLIER -66.49 -10.36 43.74 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.36 -0.382 . . . . 3.27 110.587 -179.875 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.24 -30.02 25.59 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.236 -0.438 . . . . 3.1299999999999999 111.231 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -84.18 -113.52 0.63 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.721 -0.752 . . . . 2.4700000000000002 112.226 179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.441 HD12 ' SG ' ' B' ' 528' ' ' CYS . 38.0 tp 55.41 81.25 0.12 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.98 0.419 . . . . 2.1400000000000001 110.853 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -81.98 142.76 32.11 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.1 -0.5 . . . . 3.9199999999999999 111.058 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 8.9 tp -172.62 -22.68 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 3.25 110.591 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -127.82 117.15 21.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.055 -0.521 . . . . 5.9500000000000002 110.887 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.4 ttpp 63.24 113.81 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.988 -0.551 . . . . 9.3900000000000006 111.495 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.9 m -120.41 126.44 50.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.06 -0.518 . . . . 8.9700000000000006 110.867 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -91.7 -22.71 20.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.294 -0.412 . . . . 11.67 111.003 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 80.21 -112.89 3.53 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.701 -0.761 . . . . 12.859999999999999 112.276 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 55.44 75.01 0.34 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.911 0.386 . . . . 15.369999999999999 110.893 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -73.65 101.12 3.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.068 -0.514 . . . . 16.539999999999999 110.852 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 21.6 p . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.085 -0.959 . . . . 17.93 111.681 179.93 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 44.7 pt . . . . . 0 C--O 1.237 0.419 0 N-CA-C 113.015 0.746 . . . . 2.1299999999999999 113.015 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 78.4 p -48.83 119.11 2.94 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.519 0.563 . . . . 1.29 112.519 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.76 1.53 67.92 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 120.961 -0.638 . . . . 0.0 114.436 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.39 -7.52 41.35 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 117.685 0.742 . . . . 0.02 112.434 176.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 67.5 mtt -112.45 159.97 18.22 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.116 0.484 . . . . 2.21 112.263 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 72.8 m80 -69.73 134.28 48.45 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.042 -0.725 . . . . 2.6699999999999999 109.042 174.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -41.73 -35.32 0.76 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.409 0.892 . . . . 2.6600000000000001 113.409 -173.255 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -73.88 -41.88 61.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.598 -0.728 . . . . 2.4399999999999999 112.097 -176.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -64.85 -40.18 94.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.184 0.516 . . . . 2.0800000000000001 110.823 171.244 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -53.61 -48.67 69.07 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.347 -0.842 . . . . 1.9199999999999999 111.199 177.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 514' ' ' LYS . . . . . 0.661 ' HE2' HD21 ' A' ' 7' ' ' LEU . 50.4 tttm -54.91 -57.53 11.24 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 111.912 0.338 . . . . 2.73 111.912 179.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 515' ' ' ARG . . . . . 0.4 ' O ' HG23 ' B' ' 519' ' ' THR . 57.1 ttp180 -56.71 -35.92 69.07 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 124.16 0.913 . . . . 3.75 111.037 -177.478 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.515 ' O ' HG23 ' B' ' 520' ' ' VAL . 86.1 t80 -76.12 -45.52 33.33 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.191 -0.913 . . . . 1.8899999999999999 110.539 -173.365 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 517' ' ' LEU . . . . . 0.568 ' O ' HG22 ' B' ' 521' ' ' ILE . 0.2 OUTLIER -66.8 -32.2 73.33 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.738 -0.665 . . . . 1.8999999999999999 112.658 177.104 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 518' ' ' VAL . . . . . 0.78 HG23 HD21 ' A' ' 10' ' ' LEU . 3.2 p -67.49 -35.14 72.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 118.483 -1.287 . . . . 1.3999999999999999 109.031 178.538 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 519' ' ' THR . . . . . 0.4 HG23 ' O ' ' B' ' 515' ' ' ARG . 76.3 p -73.02 -36.3 66.94 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.348 0.594 . . . . 1.1799999999999999 112.401 178.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 520' ' ' VAL . . . . . 0.515 HG23 ' O ' ' B' ' 516' ' ' PHE . 55.5 t -71.25 -42.24 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 122.162 -0.336 . . . . 1.22 111.702 -174.452 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 521' ' ' ILE . . . . . 0.568 HG22 ' O ' ' B' ' 517' ' ' LEU . 13.5 tt -90.73 -25.83 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 115.42 1.637 . . . . 1.98 115.42 -175.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -60.77 -35.19 75.81 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.712 -0.847 . . . . 2.5699999999999998 108.712 173.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 523' ' ' ASP . . . . . 0.419 ' O ' HD23 ' B' ' 527' ' ' LEU . 22.0 m-20 -92.5 -21.44 20.14 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 115.001 1.482 . . . . 2.1699999999999999 115.001 -177.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 70.1 mt -70.69 -45.27 65.33 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.314 -0.624 . . . . 1.48 109.314 168.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 70.1 mt -52.32 -45.42 65.59 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.315 0.579 . . . . 1.95 110.962 169.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.47 -40.53 94.38 Favored Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 527' ' ' LEU . . . . . 0.419 HD23 ' O ' ' B' ' 523' ' ' ASP . 2.6 mm? -63.63 -36.14 82.83 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.036 0.446 . . . . 1.6699999999999999 111.426 175.725 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 528' ' ' CYS . . . . . 0.441 ' SG ' HD12 ' A' ' 17' ' ' LEU . 40.2 t -63.54 -47.68 80.61 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.023 -0.535 . . . . 0.58999999999999997 110.699 -175.282 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.67 -29.6 70.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.485 -0.78 . . . . 2.5 112.566 173.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -71.78 -54.68 9.42 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.283 0.846 . . . . 2.2400000000000002 113.283 -177.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 531' ' ' LYS . . . . . 0.563 ' HD2' HD11 ' B' ' 540' ' ' ILE . 80.0 mttt -68.73 137.89 54.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.065 -0.516 . . . . 2.2799999999999998 111.047 -177.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -96.42 160.63 14.31 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.837 -0.619 . . . . 4.21 110.158 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.47 119.58 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.848 -0.614 . . . . 0.0 114.022 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -47.02 -36.66 8.14 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.259 0.837 . . . . 2.9500000000000002 113.259 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -50.56 -51.85 44.32 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.373 -0.531 . . . . 2.2000000000000002 110.809 174.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.06 -44.83 83.37 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.62 0.6 . . . . 1.47 112.62 178.314 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 537' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -67.87 -31.9 72.03 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.272 -174.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 538' ' ' ALA . . . . . 0.407 ' HB2' ' CD2' ' B' ' 577' ' ' HIS . . . -68.21 -47.0 69.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.862 -0.608 . . . . 0.040000000000000001 111.048 178.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 48.4 mm -58.12 -54.98 25.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 121.549 0.69 . . . . 1.8200000000000001 111.234 173.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 540' ' ' ILE . . . . . 0.563 HD11 ' HD2' ' B' ' 531' ' ' LYS . 80.7 mt -56.75 -48.14 81.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.59 -178.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.46 -44.09 84.52 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 113.595 0.961 . . . . 0.02 113.595 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 62.3 m -60.42 -38.81 85.23 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 120.545 -0.462 . . . . 1.2 110.306 -178.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 40.5 t-20 -68.92 -47.12 66.54 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 114.365 1.246 . . . . 2.0299999999999998 114.365 -175.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 544' ' ' ILE . . . . . 0.411 HG23 HG13 ' B' ' 521' ' ' ILE . 95.1 mt -52.6 -46.06 48.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.424 -0.954 . . . . 1.8100000000000001 108.424 170.074 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 545' ' ' MET . . . . . 0.754 ' HB3' HG21 ' B' ' 587' ' ' THR . 45.3 mtp -63.97 -42.33 97.28 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.78 -0.768 . . . . 2.6000000000000001 112.818 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -58.35 -48.71 79.7 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 119.145 -1.022 . . . . 2.0800000000000001 109.932 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 80.8 mt -55.07 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.8 0.667 . . . . 1.5 112.8 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 548' ' ' VAL . . . . . 0.441 HG22 ' HA ' ' B' ' 545' ' ' MET . 33.8 m -47.42 -44.17 9.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.812 -0.755 . . . . 1.3999999999999999 111.427 176.265 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 549' ' ' GLY . . . . . 0.496 ' HA2' HD11 ' B' ' 591' ' ' ILE . . . -57.41 -28.08 58.9 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -86.99 -9.57 55.26 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.614 0.598 . . . . 2.27 112.614 -175.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -120.43 59.74 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.781 1.03 . . . . 3.5299999999999998 113.781 -176.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.03 -39.36 91.69 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 O-C-N 122.071 0.511 . . . . 0.46000000000000002 113.134 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 9.9 mmm180 -56.23 -46.78 79.4 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 121.169 0.509 . . . . 3.8700000000000001 109.974 -174.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -48.9 -59.84 3.25 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 123.89 0.876 . . . . 0.69999999999999996 112.101 167.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 555' ' ' LEU . . . . . . . . . . . . . 11.2 mp -54.26 -48.56 71.05 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 116.267 -0.424 . . . . 1.49 110.202 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 556' ' ' ARG . . . . . 0.484 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 78.6 ttt180 -53.93 -35.87 62.16 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 113.827 1.047 . . . . 3.0899999999999999 113.827 -178.278 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.06 -12.17 50.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.517 -0.473 . . . . 0.0 112.102 -177.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -128.23 78.5 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 2.9300000000000002 114.388 -177.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 33.4 p90 -50.51 -48.28 57.06 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 116.57 2.063 . . . . 3.1099999999999999 116.57 -176.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -56.57 -36.68 69.62 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.23 -0.441 . . . . 3.3199999999999998 111.136 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 561' ' ' PHE . . . . . 0.489 ' O ' HG23 ' B' ' 565' ' ' VAL . 3.5 t80 -74.89 -45.08 45.24 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.092 -1.043 . . . . 1.25 111.978 175.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 562' ' ' LEU . . . . . 0.419 ' O ' HG23 ' B' ' 566' ' ' VAL . 2.9 tt -49.99 -59.13 4.18 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 122.403 0.281 . . . . 1.3200000000000001 110.34 175.004 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.14 -38.63 40.18 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.922 1.082 . . . . 2.7400000000000002 113.922 178.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 20.1 p -71.89 -39.31 69.66 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.732 -0.667 . . . . 1.24 110.356 -176.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 565' ' ' VAL . . . . . 0.489 HG23 ' O ' ' B' ' 561' ' ' PHE . 68.5 t -62.81 -41.31 92.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.685 -0.689 . . . . 1.1899999999999999 112.542 173.358 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 566' ' ' VAL . . . . . 0.562 HG21 ' HZ ' ' B' ' 599' ' ' PHE . 58.1 t -71.0 -50.93 39.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.542 -0.463 . . . . 1.3600000000000001 110.844 -176.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -51.08 -37.37 45.32 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.996 -0.547 . . . . 1.9399999999999999 112.012 170.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 568' ' ' LYS . . . . . 0.514 ' HD3' HD21 ' A' ' 14' ' ' LEU . 29.2 ttpt -72.67 -32.6 65.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.753 -0.462 . . . . 3.5299999999999998 109.753 -179.203 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 569' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' B' ' 573' ' ' MET . 4.2 mp -67.46 -36.5 81.28 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.73 -0.841 . . . . 2.0099999999999998 108.73 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 570' ' ' PHE . . . . . 0.516 ' HD1' HG13 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.38 -39.38 92.17 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.872 -0.418 . . . . 3.77 109.872 178.372 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -57.66 -53.45 58.06 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 119.999 -0.68 . . . . 2.4700000000000002 110.545 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.56 -9.86 10.16 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.079 1.14 . . . . 1.23 114.079 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 573' ' ' MET . . . . . 0.924 ' HB3' HD11 ' B' ' 625' ' ' LEU . 64.0 mtt -76.42 -5.35 46.93 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.639 0.733 . . . . 2.1099999999999999 109.662 178.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -109.4 -0.48 18.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.755 -1.112 . . . . 3.2000000000000002 111.428 173.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 575' ' ' GLU . . . . . 0.445 ' HG2' HG11 ' B' ' 580' ' ' VAL . 14.4 tp10 -68.48 130.2 42.17 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.214 -0.448 . . . . 1.55 110.079 177.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 7.2 m -87.87 -21.24 25.1 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.042 0.756 . . . . 1.3999999999999999 113.042 -177.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 577' ' ' HIS . . . . . 0.576 ' HD1' ' H ' ' B' ' 578' ' ' ASP . 0.8 OUTLIER -60.22 128.03 34.75 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.411 0.624 . . . . 2.8500000000000001 112.596 -175.4 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 578' ' ' ASP . . . . . 0.576 ' H ' ' HD1' ' B' ' 577' ' ' HIS . 7.1 m-20 -44.88 125.88 5.38 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.388 -0.824 . . . . 2.1499999999999999 113.063 -171.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.26 -34.75 4.75 Favored Glycine 0 C--O 1.222 -0.627 0 N-CA-C 116.29 1.276 . . . . 0.0 116.29 174.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 580' ' ' VAL . . . . . 0.445 HG11 ' HG2' ' B' ' 575' ' ' GLU . 58.1 t -53.68 -46.42 61.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.146 0.795 . . . . 1.29 113.146 -175.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -59.6 -42.31 92.29 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.383 0.512 . . . . 1.99 112.383 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -60.54 -42.42 96.46 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.213 0.449 . . . . 2.23 112.213 172.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 25.7 mmt -60.71 -49.48 77.32 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.058 -0.257 . . . . 2.5800000000000001 110.447 175.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.86 -42.83 80.46 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.159 -0.473 . . . . 0.029999999999999999 111.79 -177.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 585' ' ' CYS . . . . . 0.464 ' SG ' ' HG3' ' B' ' 629' ' ' GLN . 23.6 p -74.4 -40.92 61.73 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 119.957 -0.697 . . . . 1.5 111.984 -177.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 586' ' ' ASP . . . . . 0.489 ' O ' HG12 ' B' ' 589' ' ' ILE . 18.0 t70 -59.53 -46.38 89.04 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.273 -0.421 . . . . 1.98 111.92 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 587' ' ' THR . . . . . 0.754 HG21 ' HB3' ' B' ' 545' ' ' MET . 40.4 p -62.19 -41.18 98.1 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.3 110.43 175.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -61.55 -32.14 72.2 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.035 -0.53 . . . . 0.53000000000000003 111.153 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 589' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 586' ' ' ASP . 41.5 pt -79.94 -35.85 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.871 -1.932 . . . . 1.97 109.76 -175.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -57.52 -50.04 74.38 Favored 'General case' 0 C--O 1.221 -0.438 0 N-CA-C 107.701 -1.222 . . . . 2.6200000000000001 107.701 176.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 591' ' ' ILE . . . . . 0.496 HD11 ' HA2' ' B' ' 549' ' ' GLY . 1.7 mp -63.77 -43.74 98.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.689 -0.687 . . . . 1.96 112.815 -176.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.04 93.23 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.392 -0.523 . . . . 0.0 112.301 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -62.4 -70.06 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 119.112 -1.035 . . . . 2.3599999999999999 109.793 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -56.09 -23.84 36.41 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 116.608 2.077 . . . . 2.1899999999999999 116.608 -176.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.1 p -121.68 25.25 9.38 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 114.201 1.186 . . . . 1.26 114.201 -178.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -48.46 -38.6 20.37 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 115.825 1.787 . . . . 3.5800000000000001 115.825 -172.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 597' ' ' ARG . . . . . 0.421 ' O ' HG12 ' B' ' 600' ' ' VAL . 54.8 mtp180 -69.54 -32.63 71.55 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.201 0.815 . . . . 3.7400000000000002 113.201 -175.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 598' ' ' HIS . . . . . 0.484 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 61.9 m-70 -70.2 -3.77 18.51 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.603 -0.726 . . . . 2.1400000000000001 112.05 -173.549 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 599' ' ' PHE . . . . . 0.562 ' HZ ' HG21 ' B' ' 566' ' ' VAL . 3.2 m-85 -105.52 -16.95 14.57 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 123.597 0.561 . . . . 2.9500000000000002 110.257 -176.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 600' ' ' VAL . . . . . 0.421 HG12 ' O ' ' B' ' 597' ' ' ARG . 15.0 p -105.76 -24.38 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.091 -0.959 . . . . 1.4199999999999999 111.319 -175.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -102.03 139.51 37.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.578 -0.849 . . . . 2.3399999999999999 111.55 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 16.1 m -60.89 122.71 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.611 -0.885 . . . . 1.3700000000000001 108.611 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -92.78 167.29 11.96 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 123.648 0.592 . . . . 2.6800000000000002 110.06 -177.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 42.9 t -71.93 128.93 35.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 N-CA-C 112.971 0.73 . . . . 1.27 112.971 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.38 6.53 64.38 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.062 -175.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 606' ' ' GLU . . . . . 0.509 ' HG2' ' H ' ' B' ' 608' ' ' MET . 34.7 tt0 -131.49 158.01 42.03 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.626 -0.83 . . . . 2.5099999999999998 110.756 175.598 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 19.1 t -103.28 -22.55 4.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.055 -0.975 . . . . 1.3999999999999999 112.451 -175.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 608' ' ' MET . . . . . 0.509 ' H ' ' HG2' ' B' ' 606' ' ' GLU . 96.4 mmm -136.96 142.21 37.67 Favored Pre-proline 0 C--O 1.222 -0.343 0 N-CA-C 112.615 0.598 . . . . 2.6800000000000002 112.615 -174.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 609' ' ' PRO . . . . . 0.55 ' HB2' HG22 ' B' ' 611' ' ' ILE . 10.3 Cg_endo -52.13 130.85 36.91 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 120.83 1.02 . . . . 0.42999999999999999 112.162 179.224 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -56.9 -31.85 65.3 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.866 0.321 . . . . 2.3700000000000001 111.866 -174.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 611' ' ' ILE . . . . . 0.55 HG22 ' HB2' ' B' ' 609' ' ' PRO . 6.7 tp -50.0 -44.88 22.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 CA-C-O 120.787 0.327 . . . . 1.8400000000000001 110.555 178.202 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 612' ' ' ASP . . . . . 0.448 ' OD1' ' HG2' ' B' ' 609' ' ' PRO . 0.9 OUTLIER -49.86 -52.0 36.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.612 0.765 . . . . 2.1499999999999999 112.875 177.698 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -59.95 -37.13 78.67 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.606 -0.438 . . . . 2.6600000000000001 110.175 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 62.7 mt -64.55 -47.96 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.117 -0.633 . . . . 1.76 111.968 178.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 615' ' ' LEU . . . . . 0.469 HD12 HD11 ' B' ' 618' ' ' ILE . 57.2 tp -62.6 -31.13 71.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.955 0.724 . . . . 1.8400000000000001 112.955 -177.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -79.57 2.11 23.46 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.599 1.333 . . . . 2.0600000000000001 114.599 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 617' ' ' ASN . . . . . 0.528 ' HB3' HG22 ' B' ' 620' ' ' THR . 91.0 m-20 -142.48 15.79 2.01 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 113.104 0.779 . . . . 1.97 113.104 -174.259 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 618' ' ' ILE . . . . . 0.469 HD11 HD12 ' B' ' 615' ' ' LEU . 81.0 mt -46.93 -47.06 8.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 C-N-CA 118.929 -1.109 . . . . 2.0099999999999998 110.177 -176.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 619' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -63.19 -51.1 67.7 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.703 1.001 . . . . 2.2799999999999998 113.703 -176.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 620' ' ' THR . . . . . 0.528 HG22 ' HB3' ' B' ' 617' ' ' ASN . 8.8 t -56.94 -31.82 65.35 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.46 -0.896 . . . . 1.3200000000000001 110.741 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 621' ' ' ILE . . . . . 0.516 HG13 ' HD1' ' B' ' 570' ' ' PHE . 15.7 tt -79.36 -42.67 23.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 115.267 1.58 . . . . 2.0 115.267 -178.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 622' ' ' ILE . . . . . 0.829 ' HA ' HD13 ' B' ' 625' ' ' LEU . 0.2 OUTLIER -87.7 -6.27 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.011 1.485 . . . . 2.0899999999999999 115.011 -177.586 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.7 t -20.05 -58.28 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 116.538 2.051 . . . . 1.47 116.538 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -99.33 -7.53 26.16 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.061 -1.427 . . . . 2.0699999999999998 111.007 -163.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 625' ' ' LEU . . . . . 0.924 HD11 ' HB3' ' B' ' 573' ' ' MET . 9.0 mp -71.87 146.85 47.64 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 123.326 0.391 . . . . 1.6699999999999999 111.769 -173.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 626' ' ' GLN . . . . . 0.504 ' O ' HG23 ' B' ' 630' ' ' VAL . 11.8 pt20 -76.69 162.08 71.8 Favored Pre-proline 0 CA--C 1.519 -0.22 0 N-CA-C 108.843 -0.799 . . . . 2.3500000000000001 108.843 174.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 627' ' ' PRO . . . . . 0.405 ' HD2' ' HB2' ' B' ' 626' ' ' GLN . 85.2 Cg_exo -47.86 -43.63 29.0 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.792 1.42 . . . . 0.44 115.792 -178.432 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -67.29 -43.07 82.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.573 -0.528 . . . . 2.6200000000000001 109.573 -174.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 629' ' ' GLN . . . . . 0.464 ' HG3' ' SG ' ' B' ' 585' ' ' CYS . 1.1 mp0 -63.18 -38.37 90.89 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.934 -0.575 . . . . 2.0600000000000001 110.928 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 630' ' ' VAL . . . . . 0.517 HG22 HG12 ' B' ' 622' ' ' ILE . 59.8 t . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.207 -0.901 . . . . 1.3 110.687 176.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 39.5 pt . . . . . 0 C--O 1.236 0.342 0 N-CA-C 113.024 0.75 . . . . 2.1299999999999999 113.024 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 80.5 p -48.89 119.18 3.01 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.576 0.584 . . . . 1.29 112.576 174.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.82 1.43 67.84 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 120.913 -0.66 . . . . 0.0 114.476 -179.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.33 -7.63 41.25 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 117.659 0.73 . . . . 0.02 112.431 176.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 86.4 mtp -112.41 159.96 18.2 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.29 0.478 . . . . 2.21 112.29 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -69.67 134.24 48.46 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 109.146 -0.687 . . . . 2.6699999999999999 109.146 174.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -41.71 -35.42 0.78 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.37 0.878 . . . . 2.6600000000000001 113.37 -173.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -73.84 -41.89 61.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.584 -0.734 . . . . 2.4399999999999999 112.07 -176.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -64.83 -40.11 94.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.158 0.504 . . . . 2.0800000000000001 110.88 171.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -53.72 -48.58 69.46 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.303 -0.862 . . . . 1.9199999999999999 111.205 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -54.85 -57.6 10.94 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 111.9 0.333 . . . . 2.73 111.9 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 515' ' ' ARG . . . . . 0.479 ' O ' HG12 ' B' ' 518' ' ' VAL . 81.2 mtp180 -56.63 -35.93 68.9 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.157 0.911 . . . . 3.75 111.086 -177.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.699 ' O ' HG13 ' B' ' 520' ' ' VAL . 76.5 t80 -76.14 -45.56 33.01 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.104 -0.953 . . . . 1.8899999999999999 110.504 -173.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 517' ' ' LEU . . . . . 0.759 ' HA ' HG22 ' B' ' 520' ' ' VAL . 8.5 tp -66.76 -32.23 73.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.731 -0.668 . . . . 1.8999999999999999 112.591 177.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 518' ' ' VAL . . . . . 0.479 HG12 ' O ' ' B' ' 515' ' ' ARG . 7.7 p -67.57 -35.07 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 118.483 -1.287 . . . . 1.3999999999999999 109.021 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 42.8 m -72.9 -36.38 67.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.41 0.624 . . . . 1.1799999999999999 112.444 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 520' ' ' VAL . . . . . 0.786 HG23 HG13 ' B' ' 521' ' ' ILE . 25.5 m -71.21 -42.3 75.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.395 -0.366 . . . . 1.22 111.636 -174.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 521' ' ' ILE . . . . . 0.786 HG13 HG23 ' B' ' 520' ' ' VAL . 82.4 mt -90.69 -25.86 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 N-CA-C 115.418 1.636 . . . . 1.98 115.418 -175.097 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -60.82 -35.16 75.81 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.717 -0.845 . . . . 2.5699999999999998 108.717 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -92.4 -21.62 20.11 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.032 1.493 . . . . 2.1699999999999999 115.032 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 524' ' ' LEU . . . . . 0.635 HD23 ' HB ' ' B' ' 544' ' ' ILE . 16.4 tp -70.53 -45.45 65.51 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 109.325 -0.621 . . . . 1.48 109.325 168.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 43.2 tp -52.15 -45.52 65.06 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-O 121.211 0.529 . . . . 1.95 110.953 169.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.46 -40.57 94.42 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 527' ' ' LEU . . . . . 0.401 HD23 HD12 ' B' ' 540' ' ' ILE . 52.2 tp -63.53 -36.16 82.87 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.057 0.456 . . . . 1.6699999999999999 111.483 175.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 49.9 t -63.47 -47.74 80.58 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.012 -0.54 . . . . 0.58999999999999997 110.705 -175.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -61.68 -29.65 70.22 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.508 -0.769 . . . . 2.5 112.56 173.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -71.65 -54.71 9.49 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.369 0.877 . . . . 2.2400000000000002 113.369 -177.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -68.76 137.99 54.49 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.98 -0.555 . . . . 2.2799999999999998 111.031 -177.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -96.49 160.72 14.25 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.749 -0.66 . . . . 4.21 110.19 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.64 1.35 Allowed Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.912 -0.585 . . . . 0.0 114.031 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -47.18 -36.61 8.89 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 113.175 0.805 . . . . 2.9500000000000002 113.175 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -50.53 -51.86 43.88 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.376 -0.53 . . . . 2.2000000000000002 110.823 174.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -66.05 -44.85 83.37 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.62 0.6 . . . . 1.47 112.62 178.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 537' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -67.87 -31.95 72.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.272 -174.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.12 -46.96 69.45 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 115.815 -0.629 . . . . 0.040000000000000001 111.149 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 74.4 mt -58.24 -54.9 26.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 1.8200000000000001 111.218 173.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 540' ' ' ILE . . . . . 0.401 HD12 HD23 ' B' ' 527' ' ' LEU . 47.0 mm -56.73 -48.17 81.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.601 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 541' ' ' ALA . . . . . 0.412 ' O ' ' CG2' ' B' ' 544' ' ' ILE . . . -57.48 -43.98 84.54 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 113.599 0.963 . . . . 0.02 113.599 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 542' ' ' SER . . . . . 0.56 ' HA ' ' HE3' ' B' ' 545' ' ' MET . 92.5 p -60.54 -38.7 85.31 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.557 -0.457 . . . . 1.2 110.301 -178.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -69.1 -47.07 66.14 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 114.298 1.221 . . . . 2.0299999999999998 114.298 -175.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 544' ' ' ILE . . . . . 0.635 ' HB ' HD23 ' B' ' 524' ' ' LEU . 7.8 tt -52.6 -45.92 48.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 108.52 -0.919 . . . . 1.8100000000000001 108.52 170.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 545' ' ' MET . . . . . 0.56 ' HE3' ' HA ' ' B' ' 542' ' ' SER . 74.5 mtm -64.03 -42.33 97.13 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.744 -0.782 . . . . 2.6000000000000001 112.766 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -58.39 -48.73 79.68 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 119.224 -0.991 . . . . 2.0800000000000001 109.838 176.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 36.1 mm -55.05 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.794 0.664 . . . . 1.5 112.794 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 548' ' ' VAL . . . . . 0.621 HG22 HD11 ' B' ' 555' ' ' LEU . 9.3 p -47.36 -44.21 8.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 C-N-CA 119.77 -0.772 . . . . 1.3999999999999999 111.488 176.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.05 58.85 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.845 -0.534 . . . . 0.0 112.908 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 550' ' ' GLN . . . . . 0.459 ' C ' ' HD3' ' B' ' 552' ' ' PRO . 16.1 mm100 -87.06 -9.56 55.14 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.617 0.599 . . . . 2.27 112.617 -175.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -120.39 59.67 7.01 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.807 1.04 . . . . 3.5299999999999998 113.807 -177.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 552' ' ' PRO . . . . . 0.459 ' HD3' ' C ' ' B' ' 550' ' ' GLN . 34.4 Cg_exo -55.98 -39.34 91.81 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.068 0.509 . . . . 0.46000000000000002 113.152 177.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -56.3 -46.65 79.72 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 121.164 0.507 . . . . 3.8700000000000001 109.997 -174.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -49.02 -59.64 3.45 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 123.931 0.892 . . . . 0.69999999999999996 112.158 167.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 555' ' ' LEU . . . . . 0.621 HD11 HG22 ' B' ' 548' ' ' VAL . 82.2 mt -54.41 -48.51 71.53 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 116.271 -0.422 . . . . 1.49 110.195 -179.003 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . 0.547 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 56.0 ttt180 -53.98 -35.82 62.24 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.833 1.049 . . . . 3.0899999999999999 113.833 -178.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.05 -12.18 50.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.538 -0.465 . . . . 0.0 112.106 -177.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 51.0 m-70 -128.21 78.51 1.84 Allowed 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.393 1.257 . . . . 2.9300000000000002 114.393 -177.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 5.6 m-90 -50.63 -48.22 58.15 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.492 2.034 . . . . 3.1099999999999999 116.492 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -56.68 -36.56 69.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.423 . . . . 3.3199999999999998 111.152 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 561' ' ' PHE . . . . . 0.516 ' O ' HG23 ' B' ' 565' ' ' VAL . 1.4 t80 -74.92 -45.12 44.7 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.126 -1.03 . . . . 1.25 111.882 175.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . 0.638 HD12 HD11 ' B' ' 591' ' ' ILE . 26.2 tp -50.01 -59.09 4.22 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 122.44 0.296 . . . . 1.3200000000000001 110.314 175.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -50.24 -38.63 41.57 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.864 1.061 . . . . 2.7400000000000002 113.864 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 89.9 m -71.73 -39.42 70.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.583 0.706 . . . . 1.24 110.413 -176.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 565' ' ' VAL . . . . . 0.516 HG23 ' O ' ' B' ' 561' ' ' PHE . 59.3 t -62.81 -41.34 92.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 115.667 -0.697 . . . . 1.1899999999999999 112.529 173.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 566' ' ' VAL . . . . . 0.479 HG23 ' O ' ' B' ' 562' ' ' LEU . 42.3 t -70.94 -50.82 40.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.49 -0.484 . . . . 1.3600000000000001 110.873 -176.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -51.1 -37.48 46.12 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.075 -0.512 . . . . 1.9399999999999999 111.978 170.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 568' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' B' ' 568' ' ' LYS . 25.5 mmtp -72.55 -32.73 66.31 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.723 -0.473 . . . . 3.5299999999999998 109.723 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 569' ' ' LEU . . . . . 0.429 ' O ' ' HG3' ' B' ' 573' ' ' MET . 57.1 mt -67.52 -36.43 81.02 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 108.66 -0.867 . . . . 2.0099999999999998 108.66 177.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 570' ' ' PHE . . . . . 0.426 ' CE2' HG12 ' B' ' 566' ' ' VAL . 16.2 m-85 -65.4 -39.38 92.11 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.859 -0.423 . . . . 3.77 109.859 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -57.69 -53.53 57.13 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.881 -0.727 . . . . 2.4700000000000002 110.483 176.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -62.39 -9.89 9.7 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.158 1.17 . . . . 1.23 114.158 -177.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 573' ' ' MET . . . . . 0.82 ' HB3' HD11 ' B' ' 625' ' ' LEU . 26.5 mtm -76.42 -5.29 46.69 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.671 0.748 . . . . 2.1099999999999999 109.667 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -109.49 -0.59 18.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.765 -1.107 . . . . 3.2000000000000002 111.395 173.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 575' ' ' GLU . . . . . 0.462 ' HG2' HG11 ' B' ' 580' ' ' VAL . 18.6 tp10 -68.46 130.26 42.36 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.233 -0.44 . . . . 1.55 110.188 177.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 10.2 t -87.88 -21.34 25.04 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 112.947 0.721 . . . . 1.3999999999999999 112.947 -177.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -60.17 128.01 34.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.48 0.657 . . . . 2.8500000000000001 112.516 -175.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -44.81 125.83 5.28 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.391 -0.822 . . . . 2.1499999999999999 113.095 -171.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.62 4.83 Favored Glycine 0 C--O 1.223 -0.57 0 N-CA-C 116.294 1.278 . . . . 0.0 116.294 174.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 580' ' ' VAL . . . . . 0.462 HG11 ' HG2' ' B' ' 575' ' ' GLU . 43.1 t -53.88 -46.35 63.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 113.057 0.762 . . . . 1.29 113.057 -175.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.653 ' NE2' ' H ' ' B' ' 581' ' ' GLN . 0.1 OUTLIER -59.64 -42.25 92.34 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.409 0.522 . . . . 1.99 112.409 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -60.54 -42.45 96.54 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.159 0.429 . . . . 2.23 112.159 172.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 583' ' ' MET . . . . . 0.454 ' HG2' ' HA ' ' B' ' 542' ' ' SER . 3.1 tpt -60.7 -49.53 77.15 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 121.058 -0.257 . . . . 2.5800000000000001 110.416 175.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.89 80.29 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.181 -0.463 . . . . 0.029999999999999999 111.744 -177.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 81.2 m -74.44 -40.92 61.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 119.976 -0.69 . . . . 1.5 111.938 -177.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 586' ' ' ASP . . . . . 0.639 ' O ' HG22 ' B' ' 589' ' ' ILE . 2.0 m-20 -59.6 -46.32 89.3 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.273 -0.421 . . . . 1.98 111.974 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 87.2 m -62.16 -41.22 98.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.3 110.43 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 588' ' ' PHE . . . . . 0.587 ' O ' HG22 ' B' ' 591' ' ' ILE . 87.8 t80 -61.4 -32.22 72.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.047 -0.524 . . . . 0.53000000000000003 111.232 -177.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 589' ' ' ILE . . . . . 0.639 HG22 ' O ' ' B' ' 586' ' ' ASP . 9.7 tp -79.91 -35.99 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.871 -1.932 . . . . 1.97 109.74 -175.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -57.41 -50.04 74.3 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 107.752 -1.203 . . . . 2.6200000000000001 107.752 176.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . 0.638 HD11 HD12 ' B' ' 562' ' ' LEU . 12.2 tt -63.75 -43.72 98.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 112.885 0.698 . . . . 1.96 112.885 -177.062 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.94 -39.12 93.42 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.407 -0.517 . . . . 0.0 112.275 177.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -62.32 -70.08 0.22 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 119.113 -1.035 . . . . 2.3599999999999999 109.848 174.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 594' ' ' LYS . . . . . 0.478 ' HD2' ' N ' ' B' ' 594' ' ' LYS . 13.5 mptt -56.15 -23.76 36.82 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 116.56 2.059 . . . . 2.1899999999999999 116.56 -176.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.1 p -121.76 25.29 9.31 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.222 1.193 . . . . 1.26 114.222 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -48.61 -38.45 20.92 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.838 1.792 . . . . 3.5800000000000001 115.838 -172.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . 0.407 ' O ' HG22 ' B' ' 600' ' ' VAL . 38.7 mmt180 -69.56 -32.61 71.5 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.202 0.816 . . . . 3.7400000000000002 113.202 -175.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 598' ' ' HIS . . . . . 0.547 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 89.4 m-70 -70.21 -3.81 18.68 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.588 -0.733 . . . . 2.1400000000000001 112.052 -173.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 599' ' ' PHE . . . . . 0.518 ' O ' HG23 ' B' ' 611' ' ' ILE . 8.7 m-85 -105.64 -16.81 14.59 Favored 'General case' 0 CA--C 1.517 -0.301 0 O-C-N 123.621 0.576 . . . . 2.9500000000000002 110.204 -176.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 600' ' ' VAL . . . . . 0.455 HG12 HD13 ' B' ' 611' ' ' ILE . 34.5 m -105.85 -24.37 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 115.084 -0.962 . . . . 1.4199999999999999 111.355 -175.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -102.0 139.46 37.6 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 119.504 -0.879 . . . . 2.3399999999999999 111.661 176.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 4.8 p -60.86 122.81 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 N-CA-C 108.639 -0.874 . . . . 1.3700000000000001 108.639 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 603' ' ' GLN . . . . . 0.451 HE21 ' HB2' ' B' ' 603' ' ' GLN . 0.0 OUTLIER -92.88 167.33 11.91 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 123.645 0.591 . . . . 2.6800000000000002 110.049 -177.589 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 30.8 t -71.91 128.81 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 113.022 0.749 . . . . 1.27 113.022 -175.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.46 6.57 64.2 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.062 -175.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 606' ' ' GLU . . . . . 0.569 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.0 tp10 -131.45 158.08 41.79 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.626 -0.83 . . . . 2.5099999999999998 110.772 175.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 40.3 t -103.34 -22.57 4.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.04 -0.982 . . . . 1.3999999999999999 112.527 -175.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 608' ' ' MET . . . . . 0.569 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 22.7 ptp -136.92 142.25 37.88 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.611 0.597 . . . . 2.6800000000000002 112.611 -174.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.11 130.9 37.05 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.889 1.06 . . . . 0.42999999999999999 112.085 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 610' ' ' PHE . . . . . 0.434 ' CE2' HD11 ' B' ' 614' ' ' ILE . 16.4 t80 -57.04 -31.8 65.54 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.794 0.294 . . . . 2.3700000000000001 111.794 -174.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 611' ' ' ILE . . . . . 0.518 HG23 ' O ' ' B' ' 599' ' ' PHE . 8.9 pt -50.14 -44.71 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 120.811 0.339 . . . . 1.8400000000000001 110.591 178.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -49.93 -52.05 36.32 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.666 0.786 . . . . 2.1499999999999999 112.844 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -59.91 -37.09 78.45 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.562 -0.455 . . . . 2.6600000000000001 110.241 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 614' ' ' ILE . . . . . 0.434 HD11 ' CE2' ' B' ' 610' ' ' PHE . 24.5 mm -64.51 -47.97 86.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.934 0 C-N-CA 120.118 -0.633 . . . . 1.76 112.013 178.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 9.9 tt -62.69 -31.08 71.92 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.978 0.733 . . . . 1.8400000000000001 112.978 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -79.54 2.12 23.36 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.621 1.341 . . . . 2.0600000000000001 114.621 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 617' ' ' ASN . . . . . 0.625 HD22 ' C ' ' B' ' 617' ' ' ASN . 0.2 OUTLIER -142.44 15.68 2.02 Favored 'General case' 0 C--O 1.242 0.685 0 N-CA-C 113.138 0.792 . . . . 1.97 113.138 -174.235 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 618' ' ' ILE . . . . . 0.494 ' O ' HG12 ' B' ' 621' ' ' ILE . 10.5 tt -46.97 -46.99 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 C-N-CA 118.921 -1.112 . . . . 2.0099999999999998 110.17 -176.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 619' ' ' ASN . . . . . 0.455 ' N ' HG23 ' B' ' 618' ' ' ILE . 78.2 m-20 -63.2 -51.05 67.88 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 113.785 1.031 . . . . 2.2799999999999998 113.785 -176.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 48.5 p -56.97 -31.83 65.42 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 119.432 -0.907 . . . . 1.3200000000000001 110.708 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 621' ' ' ILE . . . . . 0.494 HG12 ' O ' ' B' ' 618' ' ' ILE . 27.7 pt -79.3 -42.68 23.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.282 1.586 . . . . 2.0 115.282 -178.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 622' ' ' ILE . . . . . 0.708 ' HA ' HD13 ' B' ' 625' ' ' LEU . 2.8 pp -87.72 -6.21 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 115.035 1.494 . . . . 2.0899999999999999 115.035 -177.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 18.9 p -20.03 -58.34 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 116.493 2.035 . . . . 1.47 116.493 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.23 -7.58 26.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.011 -1.45 . . . . 2.0699999999999998 111.022 -163.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 625' ' ' LEU . . . . . 0.82 HD11 ' HB3' ' B' ' 573' ' ' MET . 9.1 mp -71.83 146.9 47.69 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 123.3 0.375 . . . . 1.6699999999999999 111.662 -173.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 626' ' ' GLN . . . . . 0.433 ' O ' HG23 ' B' ' 630' ' ' VAL . 1.8 mp0 -76.85 162.1 71.45 Favored Pre-proline 0 N--CA 1.464 0.254 0 N-CA-C 108.794 -0.817 . . . . 2.3500000000000001 108.794 174.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -47.78 -43.67 28.48 Favored 'Trans proline' 0 C--O 1.233 0.256 0 N-CA-C 115.799 1.423 . . . . 0.44 115.799 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -67.24 -43.03 82.97 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.423 -0.511 . . . . 2.6200000000000001 109.66 -174.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 629' ' ' GLN . . . . . 0.456 HE22 ' HB3' ' B' ' 581' ' ' GLN . 27.5 mt-30 -63.27 -38.34 90.78 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 115.98 -0.555 . . . . 2.0600000000000001 110.923 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 630' ' ' VAL . . . . . 0.433 HG23 ' O ' ' B' ' 626' ' ' GLN . 97.8 t . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.163 -0.922 . . . . 1.3 110.722 176.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 504' ' ' ILE . . . . . 0.436 ' N ' HD13 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.236 0.386 0 N-CA-C 113.063 0.764 . . . . 2.1299999999999999 113.063 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 505' ' ' SER . . . . . 0.464 ' HB3' ' HG3' ' B' ' 550' ' ' GLN . 79.8 p -48.85 119.11 2.95 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.549 0.574 . . . . 1.29 112.549 174.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.88 1.43 67.69 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.964 -0.636 . . . . 0.0 114.407 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.55 41.43 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.646 0.723 . . . . 0.02 112.443 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 54.6 mtt -112.42 160.01 18.16 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 112.32 0.489 . . . . 2.21 112.32 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -69.78 134.21 48.3 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.131 -0.692 . . . . 2.6699999999999999 109.131 174.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -41.72 -35.44 0.79 Allowed 'General case' 0 C--O 1.241 0.623 0 N-CA-C 113.361 0.874 . . . . 2.6600000000000001 113.361 -173.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -73.67 -41.98 61.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.546 -0.752 . . . . 2.4399999999999999 112.152 -176.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -64.83 -40.11 94.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.145 0.498 . . . . 2.0800000000000001 110.885 171.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 513' ' ' GLU . . . . . 0.524 ' HG3' HD23 ' B' ' 517' ' ' LEU . 9.1 tp10 -53.71 -48.66 69.36 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.365 -0.834 . . . . 1.9199999999999999 111.108 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 514' ' ' LYS . . . . . 0.528 ' O ' ' HG ' ' B' ' 517' ' ' LEU . 62.9 mttp -54.81 -57.57 11.05 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 111.918 0.34 . . . . 2.73 111.918 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 515' ' ' ARG . . . . . 0.442 ' O ' HG12 ' B' ' 518' ' ' VAL . 39.8 ttm180 -56.61 -36.0 68.93 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 124.201 0.938 . . . . 3.75 111.092 -177.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.506 ' O ' HG23 ' B' ' 520' ' ' VAL . 88.8 t80 -76.02 -45.64 33.45 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.06 -0.973 . . . . 1.8899999999999999 110.554 -173.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 517' ' ' LEU . . . . . 0.566 HD12 ' N ' ' B' ' 518' ' ' VAL . 4.4 pp -66.63 -32.26 73.47 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.708 -0.678 . . . . 1.8999999999999999 112.674 177.087 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 518' ' ' VAL . . . . . 0.566 ' N ' HD12 ' B' ' 517' ' ' LEU . 7.7 p -67.53 -35.09 72.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 118.483 -1.287 . . . . 1.3999999999999999 109.047 178.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 60.8 p -73.01 -36.33 66.99 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.1799999999999999 112.391 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 520' ' ' VAL . . . . . 0.506 HG23 ' O ' ' B' ' 516' ' ' PHE . 56.0 t -71.23 -42.37 75.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.46 -0.336 . . . . 1.22 111.611 -174.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 521' ' ' ILE . . . . . 0.52 HG22 ' O ' ' B' ' 517' ' ' LEU . 14.5 tt -90.64 -25.75 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.492 1.664 . . . . 1.98 115.492 -175.116 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -60.83 -35.28 76.15 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.683 -0.858 . . . . 2.5699999999999998 108.683 173.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -92.36 -21.5 20.21 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.02 1.489 . . . . 2.1699999999999999 115.02 -177.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 524' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' B' ' 520' ' ' VAL . 84.2 mt -70.58 -45.46 65.34 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 109.28 -0.637 . . . . 1.48 109.28 168.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 84.6 mt -52.18 -45.46 65.15 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-O 121.329 0.585 . . . . 1.95 110.97 169.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 526' ' ' GLY . . . . . 0.426 ' O ' ' HG2' ' B' ' 529' ' ' GLU . . . -66.5 -40.59 94.34 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 -178.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 67.2 mt -63.57 -36.07 82.6 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 1.6699999999999999 111.47 175.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 47.6 t -63.55 -47.73 80.37 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.08 -0.509 . . . . 0.58999999999999997 110.661 -175.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 529' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' B' ' 526' ' ' GLY . 11.1 pt-20 -61.71 -29.59 70.2 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.508 -0.769 . . . . 2.5 112.589 173.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -71.61 -54.84 9.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.322 0.86 . . . . 2.2400000000000002 113.322 -177.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 531' ' ' LYS . . . . . 0.465 ' O ' ' HD3' ' B' ' 537' ' ' LYS . 31.6 mmmt -68.71 137.87 54.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.994 -0.548 . . . . 2.2799999999999998 111.047 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 19.1 ptt180 -96.37 160.67 14.29 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.79 -0.641 . . . . 4.21 110.149 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.39 119.58 1.34 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.841 -0.618 . . . . 0.0 114.008 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -47.06 -36.63 8.32 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.248 0.832 . . . . 2.9500000000000002 113.248 177.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -50.53 -51.89 43.68 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.397 -0.521 . . . . 2.2000000000000002 110.824 174.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 536' ' ' ASN . . . . . 0.424 ' O ' ' CG1' ' B' ' 539' ' ' ILE . 32.0 m-80 -65.98 -44.86 83.64 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.697 0.628 . . . . 1.47 112.697 178.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 537' ' ' LYS . . . . . 0.465 ' HD3' ' O ' ' B' ' 531' ' ' LYS . 5.3 mmmm -67.84 -32.02 72.26 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.263 -174.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.03 -47.04 69.52 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 115.889 -0.596 . . . . 0.040000000000000001 111.156 178.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 539' ' ' ILE . . . . . 0.47 HG13 ' N ' ' B' ' 540' ' ' ILE . 43.5 pt -58.15 -54.93 25.79 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 1.8200000000000001 111.224 173.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 540' ' ' ILE . . . . . 0.47 ' N ' HG13 ' B' ' 539' ' ' ILE . 87.1 mt -56.85 -48.09 81.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 121.7 -0.625 . . . . 1.8500000000000001 110.57 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 541' ' ' ALA . . . . . 0.475 ' O ' HG12 ' B' ' 544' ' ' ILE . . . -57.35 -44.17 84.1 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 113.678 0.992 . . . . 0.02 113.678 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 95.8 p -60.33 -38.83 84.97 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 120.658 -0.417 . . . . 1.2 110.294 -178.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -69.0 -47.12 66.28 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.339 1.237 . . . . 2.0299999999999998 114.339 -175.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 544' ' ' ILE . . . . . 0.53 HG13 ' N ' ' B' ' 545' ' ' MET . 47.1 pt -52.69 -45.89 49.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.515 -0.921 . . . . 1.8100000000000001 108.515 170.075 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 545' ' ' MET . . . . . 0.818 ' HB3' HG21 ' B' ' 587' ' ' THR . 77.0 mtm -64.06 -42.34 97.04 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.761 -0.776 . . . . 2.6000000000000001 112.786 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -58.26 -48.82 79.23 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 119.279 -0.969 . . . . 2.0800000000000001 109.857 176.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 28.9 mm -55.04 -61.41 1.05 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 112.862 0.69 . . . . 1.5 112.862 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 548' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' B' ' 545' ' ' MET . 33.4 m -47.32 -44.18 8.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 C-N-CA 119.872 -0.731 . . . . 1.3999999999999999 111.498 176.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.53 -27.95 59.07 Favored Glycine 0 C--N 1.331 0.285 0 O-C-N 121.835 -0.541 . . . . 0.0 112.851 -177.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 550' ' ' GLN . . . . . 0.464 ' HG3' ' HB3' ' B' ' 505' ' ' SER . 21.8 tp60 -87.13 -9.52 55.09 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.613 0.598 . . . . 2.27 112.613 -175.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 551' ' ' TYR . . . . . 0.482 ' O ' HD23 ' B' ' 555' ' ' LEU . 74.3 m-85 -120.36 59.72 6.98 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.809 1.04 . . . . 3.5299999999999998 113.809 -177.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.01 -39.3 92.03 Favored 'Trans proline' 0 CA--C 1.53 0.298 0 O-C-N 122.127 0.54 . . . . 0.46000000000000002 113.143 177.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 15.5 ptp180 -56.35 -46.71 79.84 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 121.095 0.474 . . . . 3.8700000000000001 109.931 -174.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -48.89 -59.8 3.28 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 123.958 0.903 . . . . 0.69999999999999996 112.113 167.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 555' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' B' ' 562' ' ' LEU . 4.4 mm? -54.34 -48.51 71.33 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 116.242 -0.436 . . . . 1.49 110.236 -178.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 63.1 mtp180 -53.93 -35.79 62.09 Favored 'General case' 0 C--O 1.243 0.757 0 N-CA-C 113.828 1.047 . . . . 3.0899999999999999 113.828 -178.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.13 -12.14 50.74 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.486 -0.486 . . . . 0.0 112.058 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -128.27 78.51 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.399 1.259 . . . . 2.9300000000000002 114.399 -177.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 559' ' ' TRP . . . . . 0.504 ' O ' ' HG2' ' B' ' 563' ' ' LYS . 31.8 m-90 -50.46 -48.32 56.56 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 116.563 2.06 . . . . 3.1099999999999999 116.563 -176.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 560' ' ' LYS . . . . . 0.426 ' O ' HG23 ' B' ' 564' ' ' THR . 63.6 mttp -56.67 -36.6 69.77 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.314 -0.403 . . . . 3.3199999999999998 111.13 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 561' ' ' PHE . . . . . 0.458 ' O ' HG23 ' B' ' 565' ' ' VAL . 2.6 t80 -74.94 -45.08 44.83 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 119.087 -1.045 . . . . 1.25 111.847 175.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . 0.633 ' HA ' HD12 ' B' ' 555' ' ' LEU . 2.1 tt -50.0 -59.11 4.2 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.466 0.306 . . . . 1.3200000000000001 110.29 175.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 563' ' ' LYS . . . . . 0.69 ' HG3' HE22 ' B' ' 603' ' ' GLN . 11.0 mmpt? -50.22 -38.67 41.48 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.863 1.061 . . . . 2.7400000000000002 113.863 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 564' ' ' THR . . . . . 0.426 HG23 ' O ' ' B' ' 560' ' ' LYS . 24.0 p -71.79 -39.33 69.98 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.495 0.664 . . . . 1.24 110.408 -176.107 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 565' ' ' VAL . . . . . 0.458 HG23 ' O ' ' B' ' 561' ' ' PHE . 97.9 t -62.83 -41.32 92.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.617 -0.72 . . . . 1.1899999999999999 112.502 173.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 566' ' ' VAL . . . . . 0.527 HG12 ' O ' ' B' ' 563' ' ' LYS . 11.5 p -71.06 -50.74 40.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 C-N-CA 120.451 -0.499 . . . . 1.3600000000000001 110.872 -176.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 567' ' ' ASN . . . . . 0.442 ' N ' HG13 ' B' ' 566' ' ' VAL . 6.7 t30 -51.13 -37.42 45.97 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.067 -0.515 . . . . 1.9399999999999999 112.006 170.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 568' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' B' ' 568' ' ' LYS . 0.3 OUTLIER -72.6 -32.7 66.17 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.746 -0.465 . . . . 3.5299999999999998 109.746 -179.234 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 569' ' ' LEU . . . . . 0.447 ' O ' ' HG3' ' B' ' 573' ' ' MET . 4.1 mp -67.43 -36.52 81.39 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.67 -0.863 . . . . 2.0099999999999998 108.67 177.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 570' ' ' PHE . . . . . 0.406 ' CE2' HG22 ' B' ' 566' ' ' VAL . 19.5 m-85 -65.38 -39.28 92.06 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.907 -0.405 . . . . 3.77 109.907 178.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.73 -53.47 57.79 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 119.921 -0.711 . . . . 2.4700000000000002 110.51 176.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -62.49 -9.92 10.11 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.056 1.132 . . . . 1.23 114.056 -177.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 573' ' ' MET . . . . . 0.878 ' HB3' HD11 ' B' ' 625' ' ' LEU . 67.7 mtt -76.42 -5.31 46.75 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.618 0.723 . . . . 2.1099999999999999 109.625 178.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 30.0 m-70 -109.42 -0.51 18.91 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.842 -1.072 . . . . 3.2000000000000002 111.502 173.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 575' ' ' GLU . . . . . 0.42 ' HG2' HG11 ' B' ' 580' ' ' VAL . 13.0 tp10 -68.55 130.26 42.35 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.15 -0.477 . . . . 1.55 110.137 177.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 81.8 p -87.89 -21.27 25.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 112.981 0.734 . . . . 1.3999999999999999 112.981 -177.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -60.2 128.01 34.67 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.411 0.624 . . . . 2.8500000000000001 112.578 -175.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -44.9 125.88 5.4 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.388 -0.824 . . . . 2.1499999999999999 113.103 -171.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.22 -34.64 4.82 Favored Glycine 0 C--O 1.223 -0.553 0 N-CA-C 116.242 1.257 . . . . 0.0 116.242 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 580' ' ' VAL . . . . . 0.42 HG11 ' HG2' ' B' ' 575' ' ' GLU . 93.9 t -53.81 -46.27 63.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.232 0.827 . . . . 1.29 113.232 -175.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -59.77 -42.18 92.76 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.361 0.504 . . . . 1.99 112.361 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -60.56 -42.39 96.5 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.209 0.448 . . . . 2.23 112.209 172.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 26.4 mmt -60.76 -49.46 77.42 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 121.043 -0.263 . . . . 2.5800000000000001 110.402 175.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.92 80.2 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.265 -0.425 . . . . 0.029999999999999999 111.783 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 585' ' ' CYS . . . . . 0.417 ' O ' HG13 ' B' ' 589' ' ' ILE . 28.8 p -74.39 -40.98 61.7 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 120.066 -0.654 . . . . 1.5 111.929 -177.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -59.56 -46.35 89.16 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.209 -0.45 . . . . 1.98 111.962 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 587' ' ' THR . . . . . 0.818 HG21 ' HB3' ' B' ' 545' ' ' MET . 29.3 p -62.19 -41.23 98.14 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.298 0.639 . . . . 1.3 110.42 175.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -61.4 -32.25 72.18 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.059 -0.519 . . . . 0.53000000000000003 111.177 -177.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 589' ' ' ILE . . . . . 0.417 HG13 ' O ' ' B' ' 585' ' ' CYS . 74.4 mt -79.81 -35.97 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 C-N-CA 116.91 -1.916 . . . . 1.97 109.831 -175.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -57.48 -49.99 74.49 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 107.717 -1.216 . . . . 2.6200000000000001 107.717 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . 0.42 HG12 ' O ' ' B' ' 587' ' ' THR . 49.0 mm -63.86 -43.71 97.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.697 -0.683 . . . . 1.96 112.779 -176.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.96 -39.13 93.44 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.512 -0.475 . . . . 0.0 112.252 177.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -62.34 -70.12 0.22 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 119.129 -1.029 . . . . 2.3599999999999999 109.825 174.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -56.19 -23.65 36.62 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 116.617 2.08 . . . . 2.1899999999999999 116.617 -176.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.4 p -121.79 25.29 9.29 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.189 1.181 . . . . 1.26 114.189 -178.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -48.54 -38.58 20.84 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 115.841 1.793 . . . . 3.5800000000000001 115.841 -172.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . 0.427 ' O ' HG22 ' B' ' 600' ' ' VAL . 96.8 mtt180 -69.47 -32.64 71.68 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.302 0.852 . . . . 3.7400000000000002 113.302 -175.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -70.19 -3.78 18.48 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.523 -0.762 . . . . 2.1400000000000001 112.032 -173.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -105.6 -16.87 14.58 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.633 0.583 . . . . 2.9500000000000002 110.197 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 600' ' ' VAL . . . . . 0.427 HG22 ' O ' ' B' ' 597' ' ' ARG . 33.2 m -105.82 -24.39 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.037 -0.983 . . . . 1.4199999999999999 111.327 -175.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 601' ' ' GLN . . . . . 0.417 ' HG2' HG23 ' B' ' 600' ' ' VAL . 14.2 mm100 -101.98 139.49 37.54 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.535 -0.866 . . . . 2.3399999999999999 111.635 176.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 43.9 t -60.87 122.76 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 108.561 -0.903 . . . . 1.3700000000000001 108.561 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 603' ' ' GLN . . . . . 0.69 HE22 ' HG3' ' B' ' 563' ' ' LYS . 11.5 pt20 -92.8 167.33 11.93 Favored 'General case' 0 C--O 1.224 -0.263 0 O-C-N 123.673 0.608 . . . . 2.6800000000000002 110.116 -177.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 15.6 m -72.0 128.97 35.51 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 N-CA-C 112.98 0.733 . . . . 1.27 112.98 -175.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.33 6.57 64.43 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.11 -175.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 606' ' ' GLU . . . . . 0.572 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.3 tp10 -131.48 158.06 41.88 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.641 -0.824 . . . . 2.5099999999999998 110.757 175.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 5.3 t -103.32 -22.58 4.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.036 -0.984 . . . . 1.3999999999999999 112.472 -175.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 608' ' ' MET . . . . . 0.572 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 20.0 ptm -136.97 142.1 37.22 Favored Pre-proline 0 C--O 1.223 -0.297 0 N-CA-C 112.712 0.634 . . . . 2.6800000000000002 112.712 -174.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 609' ' ' PRO . . . . . 0.536 ' HB2' HG22 ' B' ' 611' ' ' ILE . 9.6 Cg_endo -51.91 130.8 35.92 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 120.902 1.068 . . . . 0.42999999999999999 112.202 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -57.0 -31.74 65.39 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.794 0.294 . . . . 2.3700000000000001 111.794 -174.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 611' ' ' ILE . . . . . 0.536 HG22 ' HB2' ' B' ' 609' ' ' PRO . 12.2 tt -50.16 -44.74 23.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 CA-C-O 120.782 0.325 . . . . 1.8400000000000001 110.493 178.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 612' ' ' ASP . . . . . 0.415 ' OD1' ' HG2' ' B' ' 609' ' ' PRO . 1.0 OUTLIER -50.04 -51.99 37.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.587 0.755 . . . . 2.1499999999999999 112.849 177.72 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -59.88 -37.1 78.41 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.604 -0.438 . . . . 2.6600000000000001 110.21 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 614' ' ' ILE . . . . . 0.439 ' O ' ' ND2' ' B' ' 617' ' ' ASN . 67.5 mt -64.6 -47.93 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 120.233 -0.587 . . . . 1.76 111.963 178.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 51.7 tp -62.66 -31.19 72.01 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.946 0.721 . . . . 1.8400000000000001 112.946 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -79.47 2.12 23.14 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.632 1.345 . . . . 2.0600000000000001 114.632 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 617' ' ' ASN . . . . . 0.46 ' ND2' ' C ' ' B' ' 617' ' ' ASN . 0.0 OUTLIER -142.47 15.79 2.01 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 113.141 0.793 . . . . 1.97 113.141 -174.248 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 618' ' ' ILE . . . . . 0.489 HG13 ' N ' ' B' ' 619' ' ' ASN . 19.7 pt -46.99 -47.06 8.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 C-N-CA 118.949 -1.1 . . . . 2.0099999999999998 110.139 -176.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 619' ' ' ASN . . . . . 0.489 ' N ' HG13 ' B' ' 618' ' ' ILE . 3.3 p-10 -63.21 -51.05 67.85 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.769 1.026 . . . . 2.2799999999999998 113.769 -176.355 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 620' ' ' THR . . . . . 0.411 HG23 ' ND2' ' B' ' 619' ' ' ASN . 62.9 p -56.89 -31.86 65.29 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 119.539 -0.864 . . . . 1.3200000000000001 110.774 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 621' ' ' ILE . . . . . 0.475 HG13 HG23 ' B' ' 622' ' ' ILE . 49.2 pt -79.36 -42.6 23.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 115.385 1.624 . . . . 2.0 115.385 -179.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 622' ' ' ILE . . . . . 0.72 ' HA ' HD13 ' B' ' 625' ' ' LEU . 43.5 pt -87.74 -6.24 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 115.005 1.483 . . . . 2.0899999999999999 115.005 -177.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 66.8 m -19.91 -58.38 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.543 2.053 . . . . 1.47 116.543 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -99.27 -7.63 26.13 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.983 -1.462 . . . . 2.0699999999999998 111.022 -163.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 625' ' ' LEU . . . . . 0.878 HD11 ' HB3' ' B' ' 573' ' ' MET . 8.8 mp -71.84 146.93 47.64 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 123.289 0.368 . . . . 1.6699999999999999 111.687 -173.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 626' ' ' GLN . . . . . 0.531 ' HB3' ' HD2' ' B' ' 627' ' ' PRO . 49.2 mt-30 -76.84 162.1 71.47 Favored Pre-proline 0 CA--C 1.518 -0.262 0 N-CA-C 108.818 -0.808 . . . . 2.3500000000000001 108.818 174.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 627' ' ' PRO . . . . . 0.531 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 6.1 Cg_endo -47.84 -43.62 28.91 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.813 1.428 . . . . 0.44 115.813 -178.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 628' ' ' GLN . . . . . 0.579 ' NE2' ' H ' ' B' ' 628' ' ' GLN . 2.1 mp0 -67.28 -43.03 82.78 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.396 -0.522 . . . . 2.6200000000000001 109.602 -174.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -63.25 -38.3 90.61 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.968 -0.56 . . . . 2.0600000000000001 110.92 178.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 630' ' ' VAL . . . . . 0.425 HG23 ' O ' ' B' ' 626' ' ' GLN . 93.5 t . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.22 -0.895 . . . . 1.3 110.644 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 504' ' ' ILE . . . . . 0.494 ' N ' HD13 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.291 0 N-CA-C 113.112 0.782 . . . . 2.1299999999999999 113.112 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 77.9 p -48.89 119.2 3.02 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.548 0.573 . . . . 1.29 112.548 174.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.78 1.51 67.89 Favored Glycine 0 CA--C 1.526 0.741 0 C-N-CA 120.948 -0.644 . . . . 0.0 114.468 -179.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.52 41.51 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.653 0.727 . . . . 0.02 112.456 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -112.5 160.02 18.2 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 121.196 0.522 . . . . 2.21 112.214 174.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -69.78 134.19 48.29 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.056 -0.72 . . . . 2.6699999999999999 109.056 174.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 510' ' ' GLU . . . . . 0.485 ' O ' ' HG3' ' B' ' 514' ' ' LYS . 38.7 mt-10 -41.62 -35.33 0.73 Allowed 'General case' 0 C--O 1.24 0.565 0 N-CA-C 113.498 0.925 . . . . 2.6600000000000001 113.498 -173.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -73.87 -41.94 61.49 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.485 -0.78 . . . . 2.4399999999999999 112.086 -176.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -64.93 -40.03 94.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.133 0.492 . . . . 2.0800000000000001 110.862 171.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 513' ' ' GLU . . . . . 0.438 ' O ' HD23 ' B' ' 517' ' ' LEU . 43.6 mt-10 -53.77 -48.55 69.65 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.344 -0.843 . . . . 1.9199999999999999 111.155 177.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 514' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' B' ' 510' ' ' GLU . 67.1 mttm -54.92 -57.62 10.92 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 116.476 -0.329 . . . . 2.73 111.852 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 515' ' ' ARG . . . . . 0.494 ' O ' HG22 ' B' ' 518' ' ' VAL . 5.8 tmm_? -56.59 -35.97 68.84 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.173 0.921 . . . . 3.75 111.086 -177.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -76.06 -45.59 33.42 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.118 -0.947 . . . . 1.8899999999999999 110.535 -173.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 517' ' ' LEU . . . . . 0.618 ' O ' HG22 ' B' ' 521' ' ' ILE . 4.5 mm? -66.75 -32.23 73.39 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.742 -0.663 . . . . 1.8999999999999999 112.627 177.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 518' ' ' VAL . . . . . 0.494 HG22 ' O ' ' B' ' 515' ' ' ARG . 35.9 m -67.48 -35.17 72.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 118.535 -1.266 . . . . 1.3999999999999999 109.034 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 42.2 m -72.89 -36.42 67.33 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.428 0.633 . . . . 1.1799999999999999 112.42 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 520' ' ' VAL . . . . . 0.57 HG12 ' HA ' ' B' ' 517' ' ' LEU . 7.1 p -71.19 -42.32 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 O-C-N 122.115 -0.366 . . . . 1.22 111.663 -174.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 521' ' ' ILE . . . . . 0.618 HG22 ' O ' ' B' ' 517' ' ' LEU . 14.3 tt -90.71 -25.7 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.473 1.657 . . . . 1.98 115.473 -175.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 6.1 tmmm? -60.86 -35.24 76.09 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.666 -0.864 . . . . 2.5699999999999998 108.666 173.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -92.41 -21.54 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.008 1.484 . . . . 2.1699999999999999 115.008 -177.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 80.5 mt -70.52 -45.44 65.56 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.315 -0.624 . . . . 1.48 109.315 168.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 85.0 mt -52.23 -45.42 65.28 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-O 121.273 0.559 . . . . 1.95 110.971 169.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.56 -40.48 94.21 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 -178.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 66.3 mt -63.7 -36.08 82.67 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.021 0.439 . . . . 1.6699999999999999 111.382 175.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 40.7 t -63.47 -47.74 80.55 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.104 -0.498 . . . . 0.58999999999999997 110.706 -175.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.7 -29.64 70.23 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.446 -0.797 . . . . 2.5 112.578 173.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -71.58 -54.76 9.43 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 113.384 0.883 . . . . 2.2400000000000002 113.384 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -68.75 137.87 54.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.937 -0.574 . . . . 2.2799999999999998 111.047 -177.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 532' ' ' ARG . . . . . 0.605 ' HD3' ' HZ1' ' B' ' 537' ' ' LYS . 21.7 tpp180 -96.42 160.73 14.25 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.798 -0.637 . . . . 4.21 110.166 178.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.62 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.854 -0.612 . . . . 0.0 114.022 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -47.08 -36.66 8.46 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.196 0.813 . . . . 2.9500000000000002 113.196 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -50.51 -51.86 43.75 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 120.367 -0.533 . . . . 2.2000000000000002 110.857 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 536' ' ' ASN . . . . . 0.499 ' O ' HG22 ' B' ' 539' ' ' ILE . 0.2 OUTLIER -66.13 -44.78 83.23 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.603 0.594 . . . . 1.47 112.603 178.359 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 537' ' ' LYS . . . . . 0.605 ' HZ1' ' HD3' ' B' ' 532' ' ' ARG . 62.6 mttp -67.87 -31.94 72.09 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.272 -174.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.17 -46.96 69.29 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.886 -0.597 . . . . 0.040000000000000001 111.092 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 539' ' ' ILE . . . . . 0.499 HG22 ' O ' ' B' ' 536' ' ' ASN . 8.2 tp -58.22 -54.91 26.09 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 1.8200000000000001 111.247 173.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 540' ' ' ILE . . . . . 0.425 ' N ' HG23 ' B' ' 539' ' ' ILE . 48.4 mm -56.79 -48.06 81.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.607 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.51 -44.06 84.72 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 113.645 0.98 . . . . 0.02 113.645 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 94.9 p -60.35 -38.88 85.22 Favored 'General case' 0 C--O 1.22 -0.478 0 C-N-CA 120.6 -0.44 . . . . 1.2 110.3 -178.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -68.95 -47.17 66.33 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 114.323 1.231 . . . . 2.0299999999999998 114.323 -175.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 544' ' ' ILE . . . . . 0.451 HG23 HG13 ' B' ' 521' ' ' ILE . 85.2 mt -52.55 -45.94 47.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.586 -0.894 . . . . 1.8100000000000001 108.586 169.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 545' ' ' MET . . . . . 0.453 ' HA ' HG12 ' B' ' 548' ' ' VAL . 74.2 mtm -64.03 -42.29 97.14 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.763 -0.775 . . . . 2.6000000000000001 112.818 179.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -58.34 -48.8 79.42 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 119.234 -0.986 . . . . 2.0800000000000001 109.838 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 95.0 mt -55.07 -61.41 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 112.846 0.684 . . . . 1.5 112.846 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 548' ' ' VAL . . . . . 0.633 HG23 HD21 ' B' ' 555' ' ' LEU . 10.5 p -47.36 -44.21 8.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.838 -0.745 . . . . 1.3999999999999999 111.442 176.213 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 549' ' ' GLY . . . . . 0.535 ' HA2' HD11 ' B' ' 591' ' ' ILE . . . -57.41 -28.08 58.9 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -87.01 -9.53 55.33 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 112.629 0.604 . . . . 2.27 112.629 -175.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 551' ' ' TYR . . . . . 0.543 ' O ' HD23 ' B' ' 555' ' ' LEU . 80.2 m-85 -120.46 59.66 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.796 1.035 . . . . 3.5299999999999998 113.796 -176.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 552' ' ' PRO . . . . . 0.549 ' HG3' ' HG2' ' B' ' 594' ' ' LYS . 13.3 Cg_endo -55.93 -39.43 91.19 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 O-C-N 122.087 0.52 . . . . 0.46000000000000002 113.114 177.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -56.26 -46.77 79.52 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 121.145 0.498 . . . . 3.8700000000000001 109.926 -174.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -48.98 -59.71 3.38 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 123.953 0.901 . . . . 0.69999999999999996 112.046 168.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 555' ' ' LEU . . . . . 0.633 HD21 HG23 ' B' ' 548' ' ' VAL . 4.3 mm? -54.3 -48.66 71.04 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 116.334 -0.394 . . . . 1.49 110.158 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . 0.571 ' HG3' ' HE2' ' B' ' 598' ' ' HIS . 21.3 ttm180 -53.87 -35.8 61.94 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.857 1.058 . . . . 3.0899999999999999 113.857 -178.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.1 -12.22 50.64 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.48 -0.488 . . . . 0.0 112.043 -177.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 33.8 m80 -128.19 78.47 1.84 Allowed 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.404 1.261 . . . . 2.9300000000000002 114.404 -177.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 47.1 p90 -50.47 -48.28 56.71 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 116.59 2.07 . . . . 3.1099999999999999 116.59 -176.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 560' ' ' LYS . . . . . 0.426 ' O ' HG23 ' B' ' 564' ' ' THR . 63.5 tttm -56.7 -36.61 69.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 3.3199999999999998 111.099 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 561' ' ' PHE . . . . . 0.449 ' O ' HG23 ' B' ' 565' ' ' VAL . 1.7 t80 -74.91 -45.15 44.61 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 119.163 -1.015 . . . . 1.25 111.847 175.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . 0.595 ' HA ' HD12 ' B' ' 555' ' ' LEU . 5.5 tt -49.96 -59.18 4.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.498 0.319 . . . . 1.3200000000000001 110.229 175.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 563' ' ' LYS . . . . . 0.466 ' HA ' HG22 ' B' ' 566' ' ' VAL . 39.7 tttm -50.2 -38.63 40.92 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.831 1.049 . . . . 2.7400000000000002 113.831 178.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 564' ' ' THR . . . . . 0.426 HG23 ' O ' ' B' ' 560' ' ' LYS . 23.3 p -71.81 -39.36 69.89 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.5 0.667 . . . . 1.24 110.366 -176.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 565' ' ' VAL . . . . . 0.449 HG23 ' O ' ' B' ' 561' ' ' PHE . 99.6 t -62.88 -41.28 92.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.628 -0.714 . . . . 1.1899999999999999 112.49 173.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 566' ' ' VAL . . . . . 0.717 ' HA ' HD23 ' B' ' 569' ' ' LEU . 30.3 m -71.01 -50.9 39.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 C-N-CA 120.485 -0.486 . . . . 1.3600000000000001 110.793 -176.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 567' ' ' ASN . . . . . 0.426 ' N ' HG23 ' B' ' 566' ' ' VAL . 15.3 m120 -51.07 -37.38 45.23 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 116.002 -0.545 . . . . 1.9399999999999999 112.007 170.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 568' ' ' LYS . . . . . 0.407 ' HE2' ' HB3' ' B' ' 568' ' ' LYS . 29.8 ttpt -72.64 -32.67 66.06 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.77 -0.456 . . . . 3.5299999999999998 109.77 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 569' ' ' LEU . . . . . 0.717 HD23 ' HA ' ' B' ' 566' ' ' VAL . 0.2 OUTLIER -67.5 -36.49 81.17 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.687 -0.857 . . . . 2.0099999999999998 108.687 177.058 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 570' ' ' PHE . . . . . 0.527 ' HD1' HG13 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.38 -39.27 92.05 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.907 -0.405 . . . . 3.77 109.907 178.346 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -57.74 -53.49 57.61 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.982 -0.687 . . . . 2.4700000000000002 110.47 176.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 572' ' ' PHE . . . . . 0.647 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 22.6 m-85 -62.45 -9.98 10.17 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.118 1.155 . . . . 1.23 114.118 -177.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 573' ' ' MET . . . . . 0.48 ' HB3' HD21 ' B' ' 625' ' ' LEU . 35.5 mtt -76.38 -5.26 46.44 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.641 0.734 . . . . 2.1099999999999999 109.651 178.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -109.44 -0.56 18.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.82 -1.082 . . . . 3.2000000000000002 111.411 173.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 575' ' ' GLU . . . . . 0.647 ' HG2' ' HA ' ' B' ' 572' ' ' PHE . 29.4 mm-40 -68.53 130.23 42.25 Favored 'General case' 0 C--O 1.233 0.221 0 O-C-N 123.422 0.451 . . . . 1.55 110.077 177.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 82.7 p -87.84 -21.36 25.07 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 113.011 0.745 . . . . 1.3999999999999999 113.011 -177.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -60.09 128.03 34.81 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.425 0.631 . . . . 2.8500000000000001 112.532 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -44.96 125.84 5.42 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.332 -0.849 . . . . 2.1499999999999999 113.119 -171.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.27 -34.69 4.8 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.219 1.247 . . . . 0.0 116.219 174.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 55.5 t -53.72 -46.42 62.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.13 0.789 . . . . 1.29 113.13 -175.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.584 ' HB3' HE22 ' B' ' 629' ' ' GLN . 66.3 mt-30 -59.57 -42.34 92.26 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.406 0.521 . . . . 1.99 112.406 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -60.53 -42.41 96.42 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 112.19 0.441 . . . . 2.23 112.19 172.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 6.9 tpt -60.7 -49.53 77.15 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 121.058 -0.257 . . . . 2.5800000000000001 110.416 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.79 -42.93 80.32 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.181 -0.463 . . . . 0.029999999999999999 111.692 -177.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 585' ' ' CYS . . . . . 0.423 ' O ' HG13 ' B' ' 589' ' ' ILE . 52.0 t -74.49 -40.87 61.55 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 119.976 -0.69 . . . . 1.5 111.91 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.54 -46.34 89.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.351 -0.386 . . . . 1.98 111.995 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 86.4 m -62.21 -41.22 98.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.3 110.381 175.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 588' ' ' PHE . . . . . 0.487 ' HB2' HD13 ' B' ' 569' ' ' LEU . 19.2 t80 -61.44 -32.23 72.2 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.089 -0.505 . . . . 0.53000000000000003 111.146 -177.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 589' ' ' ILE . . . . . 0.423 HG13 ' O ' ' B' ' 585' ' ' CYS . 68.8 mt -79.86 -35.99 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.008 0 C-N-CA 116.902 -1.919 . . . . 1.97 109.773 -175.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . 0.416 ' O ' ' HE3' ' B' ' 594' ' ' LYS . 67.8 mttm -57.47 -50.04 74.32 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 107.717 -1.216 . . . . 2.6200000000000001 107.717 176.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . 0.535 HD11 ' HA2' ' B' ' 549' ' ' GLY . 1.7 mp -63.77 -43.74 98.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.693 -0.685 . . . . 1.96 112.815 -177.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.95 -39.12 93.41 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.443 -0.503 . . . . 0.0 112.275 177.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -62.37 -70.02 0.22 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 119.096 -1.041 . . . . 2.3599999999999999 109.834 174.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 594' ' ' LYS . . . . . 0.549 ' HG2' ' HG3' ' B' ' 552' ' ' PRO . 0.0 OUTLIER -56.14 -23.8 36.91 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 116.655 2.095 . . . . 2.1899999999999999 116.655 -176.565 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 83.8 m -121.63 25.21 9.42 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.243 1.201 . . . . 1.26 114.243 -178.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -48.59 -38.49 20.9 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.792 1.775 . . . . 3.5800000000000001 115.792 -172.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . 0.425 ' O ' ' HG2' ' B' ' 601' ' ' GLN . 38.5 mmt180 -69.52 -32.69 71.69 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.202 0.816 . . . . 3.7400000000000002 113.202 -175.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 598' ' ' HIS . . . . . 0.571 ' HE2' ' HG3' ' B' ' 556' ' ' ARG . 31.3 m80 -70.13 -3.82 18.49 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.662 -0.699 . . . . 2.1400000000000001 112.053 -173.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 599' ' ' PHE . . . . . 0.544 ' O ' HG23 ' B' ' 611' ' ' ILE . 74.8 m-85 -105.52 -16.94 14.57 Favored 'General case' 0 CA--C 1.517 -0.295 0 O-C-N 123.669 0.606 . . . . 2.9500000000000002 110.279 -176.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 10.0 p -105.81 -24.36 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.031 -0.986 . . . . 1.4199999999999999 111.311 -175.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 601' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 30.3 pt20 -102.02 139.5 37.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.578 -0.849 . . . . 2.3399999999999999 111.569 176.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 6.6 m -60.91 122.71 12.1 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.441 0 N-CA-C 108.599 -0.889 . . . . 1.3700000000000001 108.599 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 603' ' ' GLN . . . . . 0.429 ' HB2' ' HE1' ' B' ' 610' ' ' PHE . 82.7 mm-40 -92.78 167.31 11.95 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 123.729 0.643 . . . . 2.6800000000000002 110.048 -177.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 62.1 t -71.98 128.99 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 113.018 0.748 . . . . 1.27 113.018 -175.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.4 6.5 64.38 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.039 -175.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -131.5 158.08 41.83 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.651 -0.82 . . . . 2.5099999999999998 110.788 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 607' ' ' VAL . . . . . 0.608 HG23 ' HG2' ' B' ' 608' ' ' MET . 19.0 m -103.29 -22.59 4.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.023 -0.989 . . . . 1.3999999999999999 112.447 -175.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 608' ' ' MET . . . . . 0.608 ' HG2' HG23 ' B' ' 607' ' ' VAL . 94.1 mmm -136.99 142.22 37.62 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 112.649 0.611 . . . . 2.6800000000000002 112.649 -174.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -52.07 130.84 36.65 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 120.899 1.066 . . . . 0.42999999999999999 112.165 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 610' ' ' PHE . . . . . 0.464 ' H ' ' HD1' ' B' ' 610' ' ' PHE . 7.8 m-85 -56.96 -31.8 65.39 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 111.874 0.324 . . . . 2.3700000000000001 111.874 -174.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 611' ' ' ILE . . . . . 0.544 HG23 ' O ' ' B' ' 599' ' ' PHE . 10.3 pt -50.07 -44.79 22.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-O 120.726 0.298 . . . . 1.8400000000000001 110.548 178.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -50.01 -52.02 37.3 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.597 0.759 . . . . 2.1499999999999999 112.821 177.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -59.96 -37.05 78.47 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.535 -0.466 . . . . 2.6600000000000001 110.234 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 614' ' ' ILE . . . . . 0.412 HD12 ' HA ' ' B' ' 611' ' ' ILE . 60.5 mt -64.44 -48.1 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 120.246 -0.582 . . . . 1.76 111.925 178.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 55.0 tp -62.61 -31.17 71.96 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.955 0.724 . . . . 1.8400000000000001 112.955 -177.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -79.5 2.12 23.23 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.621 1.341 . . . . 2.0600000000000001 114.621 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 617' ' ' ASN . . . . . 0.434 ' O ' HG22 ' B' ' 621' ' ' ILE . 38.8 m-80 -142.44 15.67 2.01 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.168 0.803 . . . . 1.97 113.168 -174.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 618' ' ' ILE . . . . . 0.466 HG13 ' N ' ' B' ' 619' ' ' ASN . 20.9 pt -46.92 -47.06 8.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 C-N-CA 118.957 -1.097 . . . . 2.0099999999999998 110.127 -176.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 619' ' ' ASN . . . . . 0.466 ' N ' HG13 ' B' ' 618' ' ' ILE . 18.8 m120 -63.2 -51.05 67.89 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.787 1.032 . . . . 2.2799999999999998 113.787 -176.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 42.0 m -56.92 -31.83 65.33 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 119.455 -0.898 . . . . 1.3200000000000001 110.763 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 621' ' ' ILE . . . . . 0.527 HG13 ' HD1' ' B' ' 570' ' ' PHE . 15.0 tt -79.35 -42.61 23.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 115.355 1.613 . . . . 2.0 115.355 -179.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 622' ' ' ILE . . . . . 0.452 HG23 HG23 ' B' ' 621' ' ' ILE . 38.3 pt -87.73 -6.24 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 115.09 1.515 . . . . 2.0899999999999999 115.09 -177.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.7 t -19.9 -58.39 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 116.598 2.073 . . . . 1.47 116.598 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -99.21 -7.56 26.33 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 113.981 -1.463 . . . . 2.0699999999999998 111.056 -164.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 625' ' ' LEU . . . . . 0.627 HD22 HE21 ' B' ' 629' ' ' GLN . 90.2 mt -71.9 146.91 47.54 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.264 0.352 . . . . 1.6699999999999999 111.654 -173.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 626' ' ' GLN . . . . . 0.451 ' O ' HG23 ' B' ' 630' ' ' VAL . 30.0 mm-40 -76.84 162.09 71.51 Favored Pre-proline 0 CA--C 1.519 -0.233 0 N-CA-C 108.773 -0.825 . . . . 2.3500000000000001 108.773 174.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -47.83 -43.61 28.88 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.813 1.428 . . . . 0.44 115.813 -178.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.25 -43.01 82.97 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 120.423 -0.511 . . . . 2.6200000000000001 109.686 -174.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 629' ' ' GLN . . . . . 0.627 HE21 HD22 ' B' ' 625' ' ' LEU . 25.2 mt-30 -63.35 -38.16 90.07 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.856 -0.611 . . . . 2.0600000000000001 110.904 178.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 630' ' ' VAL . . . . . 0.451 HG23 ' O ' ' B' ' 626' ' ' GLN . 67.2 t . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.33 -0.843 . . . . 1.3 110.687 176.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 35.0 pt . . . . . 0 C--O 1.235 0.291 0 N-CA-C 113.06 0.763 . . . . 2.1299999999999999 113.06 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 42.3 t -49.01 119.21 3.06 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.545 0.572 . . . . 1.29 112.545 174.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.79 1.5 67.87 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.995 -0.621 . . . . 0.0 114.418 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.31 -7.53 41.59 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.711 0.755 . . . . 0.02 112.443 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 508' ' ' MET . . . . . 0.426 ' HB2' ' HG2' ' B' ' 513' ' ' GLU . 24.6 mmt -112.46 159.96 18.23 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 121.123 0.487 . . . . 2.21 112.297 174.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -69.78 134.19 48.29 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.119 -0.697 . . . . 2.6699999999999999 109.119 174.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -41.67 -35.4 0.76 Allowed 'General case' 0 C--O 1.24 0.567 0 N-CA-C 113.401 0.889 . . . . 2.6600000000000001 113.401 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -73.74 -41.91 61.87 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.505 -0.771 . . . . 2.4399999999999999 112.17 -176.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -64.9 -40.18 94.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.16 0.505 . . . . 2.0800000000000001 110.831 171.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 513' ' ' GLU . . . . . 0.426 ' HG2' ' HB2' ' B' ' 508' ' ' MET . 43.2 mt-10 -53.61 -48.76 68.98 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.357 -0.838 . . . . 1.9199999999999999 111.084 177.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -54.76 -57.66 10.66 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 111.917 0.34 . . . . 2.73 111.917 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 515' ' ' ARG . . . . . 0.523 ' O ' HG12 ' B' ' 518' ' ' VAL . 39.5 ttm180 -56.6 -35.93 68.83 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.132 0.895 . . . . 3.75 111.086 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.48 ' O ' HG23 ' B' ' 520' ' ' VAL . 56.7 t80 -76.14 -45.6 32.8 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.104 -0.953 . . . . 1.8899999999999999 110.504 -173.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 517' ' ' LEU . . . . . 0.491 ' O ' HG12 ' B' ' 521' ' ' ILE . 93.6 mt -66.72 -32.1 73.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.685 -0.689 . . . . 1.8999999999999999 112.752 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 518' ' ' VAL . . . . . 0.523 HG12 ' O ' ' B' ' 515' ' ' ARG . 12.6 p -67.6 -35.03 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 118.456 -1.297 . . . . 1.3999999999999999 109.075 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 40.6 p -73.01 -36.3 66.98 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.1799999999999999 112.391 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 520' ' ' VAL . . . . . 0.48 HG23 ' O ' ' B' ' 516' ' ' PHE . 51.1 t -71.29 -42.22 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.416 -0.356 . . . . 1.22 111.716 -174.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 521' ' ' ILE . . . . . 0.491 HG12 ' O ' ' B' ' 517' ' ' LEU . 18.6 pt -90.78 -25.68 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 115.391 1.626 . . . . 1.98 115.391 -175.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 26.6 ttpp -60.91 -35.12 75.86 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.681 -0.859 . . . . 2.5699999999999998 108.681 173.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -92.43 -21.52 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.991 1.478 . . . . 2.1699999999999999 114.991 -177.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 524' ' ' LEU . . . . . 0.55 ' HG ' HD11 ' B' ' 540' ' ' ILE . 4.6 mp -70.63 -45.43 65.21 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.28 -0.637 . . . . 1.48 109.28 169.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 26.9 tp -52.15 -45.56 65.07 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.253 0.549 . . . . 1.95 110.953 169.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.43 -40.52 94.47 Favored Glycine 0 N--CA 1.445 -0.735 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 527' ' ' LEU . . . . . 0.581 HD12 HE21 ' B' ' 530' ' ' GLN . 39.6 tp -63.55 -36.12 82.73 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.035 0.445 . . . . 1.6699999999999999 111.402 175.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 41.8 t -63.49 -47.81 80.22 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 116.065 -0.516 . . . . 0.58999999999999997 110.632 -175.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -61.73 -29.5 70.16 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.467 -0.788 . . . . 2.5 112.615 173.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 530' ' ' GLN . . . . . 0.581 HE21 HD12 ' B' ' 527' ' ' LEU . 10.3 tt0 -71.7 -54.76 9.27 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.336 0.865 . . . . 2.2400000000000002 113.336 -177.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.73 137.95 54.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.014 -0.539 . . . . 2.2799999999999998 111.099 -177.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 11.1 ptp180 -96.5 160.71 14.25 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.83 -0.623 . . . . 4.21 110.117 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.62 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.854 -0.612 . . . . 0.0 114.022 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -47.14 -36.58 8.64 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.207 0.817 . . . . 2.9500000000000002 113.207 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -50.59 -51.77 45.29 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 120.373 -0.531 . . . . 2.2000000000000002 110.846 174.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -66.14 -44.84 83.01 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.59 0.589 . . . . 1.47 112.59 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 537' ' ' LYS . . . . . 0.57 ' HA ' HG22 ' B' ' 540' ' ' ILE . 60.3 mttm -67.84 -32.0 72.22 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.263 -174.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.12 -46.91 69.58 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 115.832 -0.622 . . . . 0.040000000000000001 111.137 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 78.8 mt -58.25 -54.91 26.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 1.8200000000000001 111.247 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 540' ' ' ILE . . . . . 0.57 HG22 ' HA ' ' B' ' 537' ' ' LYS . 10.6 tp -56.73 -48.16 81.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.601 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 541' ' ' ALA . . . . . 0.467 ' O ' HG22 ' B' ' 544' ' ' ILE . . . -57.47 -44.04 84.52 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.573 0.953 . . . . 0.02 113.573 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 542' ' ' SER . . . . . 0.565 ' O ' ' HG2' ' B' ' 545' ' ' MET . 94.7 p -60.47 -38.74 85.21 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.574 -0.45 . . . . 1.2 110.296 -178.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 543' ' ' ASN . . . . . 0.468 ' O ' HD13 ' B' ' 547' ' ' ILE . 75.9 m-20 -69.03 -47.14 66.16 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.316 1.228 . . . . 2.0299999999999998 114.316 -175.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 544' ' ' ILE . . . . . 0.467 HG22 ' O ' ' B' ' 541' ' ' ALA . 14.7 tt -52.64 -46.0 48.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.46 -0.941 . . . . 1.8100000000000001 108.46 170.061 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 545' ' ' MET . . . . . 0.565 ' HG2' ' O ' ' B' ' 542' ' ' SER . 0.0 OUTLIER -64.04 -42.31 97.1 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.688 -0.805 . . . . 2.6000000000000001 112.757 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -58.34 -48.76 79.52 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 119.213 -0.995 . . . . 2.0800000000000001 109.867 176.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 547' ' ' ILE . . . . . 0.468 HD13 ' O ' ' B' ' 543' ' ' ASN . 1.7 mp -55.09 -61.38 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.854 0.687 . . . . 1.5 112.854 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 548' ' ' VAL . . . . . 0.618 HG22 HD11 ' B' ' 555' ' ' LEU . 9.9 p -47.29 -44.32 8.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.843 -0.743 . . . . 1.3999999999999999 111.43 176.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.02 58.81 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.764 -0.585 . . . . 0.0 112.934 -177.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 550' ' ' GLN . . . . . 0.467 ' C ' ' HD3' ' B' ' 552' ' ' PRO . 32.5 tt0 -87.06 -9.52 55.24 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.617 0.599 . . . . 2.27 112.617 -175.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -120.44 59.64 7.08 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 113.823 1.046 . . . . 3.5299999999999998 113.823 -176.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 552' ' ' PRO . . . . . 0.586 ' HG2' ' HG2' ' B' ' 594' ' ' LYS . 44.2 Cg_exo -55.96 -39.4 91.41 Favored 'Trans proline' 0 C--O 1.222 -0.291 0 O-C-N 122.124 0.539 . . . . 0.46000000000000002 113.151 177.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 553' ' ' ARG . . . . . 0.488 ' HA ' ' HE ' ' B' ' 556' ' ' ARG . 98.9 mtt180 -56.27 -46.68 79.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.164 0.507 . . . . 3.8700000000000001 109.99 -174.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.04 -59.7 3.4 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 123.931 0.892 . . . . 0.69999999999999996 112.108 167.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 555' ' ' LEU . . . . . 0.621 ' HB3' HD13 ' B' ' 562' ' ' LEU . 87.0 mt -54.4 -48.51 71.48 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 116.322 -0.399 . . . . 1.49 110.177 -178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . 0.488 ' HE ' ' HA ' ' B' ' 553' ' ' ARG . 59.5 mtm180 -53.93 -35.87 62.16 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.827 1.047 . . . . 3.0899999999999999 113.827 -178.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.03 -12.26 50.73 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.528 -0.469 . . . . 0.0 112.078 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 558' ' ' HIS . . . . . 0.577 ' ND1' ' HB2' ' B' ' 561' ' ' PHE . 8.5 t-160 -128.22 78.48 1.84 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.405 1.261 . . . . 2.9300000000000002 114.405 -177.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 34.6 p90 -50.48 -48.29 56.8 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 116.526 2.047 . . . . 3.1099999999999999 116.526 -176.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 560' ' ' LYS . . . . . 0.418 ' O ' HG23 ' B' ' 564' ' ' THR . 5.0 tppp? -56.71 -36.55 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.303 -0.408 . . . . 3.3199999999999998 111.15 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 561' ' ' PHE . . . . . 0.577 ' HB2' ' ND1' ' B' ' 558' ' ' HIS . 9.0 t80 -74.96 -45.06 44.86 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 119.1 -1.04 . . . . 1.25 111.908 175.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . 0.621 HD13 ' HB3' ' B' ' 555' ' ' LEU . 62.3 tp -49.97 -59.22 4.09 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.515 0.326 . . . . 1.3200000000000001 110.255 175.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 563' ' ' LYS . . . . . 0.511 ' O ' HG12 ' B' ' 566' ' ' VAL . 39.7 ttmt -50.16 -38.66 40.54 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.893 1.071 . . . . 2.7400000000000002 113.893 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 564' ' ' THR . . . . . 0.418 HG23 ' O ' ' B' ' 560' ' ' LYS . 23.5 p -71.71 -39.42 70.17 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.572 0.701 . . . . 1.24 110.412 -176.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 565' ' ' VAL . . . . . 0.467 HG23 ' O ' ' B' ' 561' ' ' PHE . 85.1 t -62.84 -41.34 92.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.646 -0.706 . . . . 1.1899999999999999 112.527 173.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 566' ' ' VAL . . . . . 0.511 HG12 ' O ' ' B' ' 563' ' ' LYS . 13.1 p -70.96 -50.85 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.537 -0.465 . . . . 1.3600000000000001 110.875 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 567' ' ' ASN . . . . . 0.437 ' N ' HG13 ' B' ' 566' ' ' VAL . 2.8 t-20 -51.04 -37.47 45.55 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.009 -0.541 . . . . 1.9399999999999999 112.044 170.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -72.69 -32.63 65.93 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.716 -0.475 . . . . 3.5299999999999998 109.716 -179.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 569' ' ' LEU . . . . . 0.489 ' O ' ' HG3' ' B' ' 573' ' ' MET . 60.1 mt -67.5 -36.41 81.02 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 108.696 -0.853 . . . . 2.0099999999999998 108.696 177.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 570' ' ' PHE . . . . . 0.41 ' CE2' HG22 ' B' ' 566' ' ' VAL . 25.2 m-85 -65.35 -39.38 92.28 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.868 -0.419 . . . . 3.77 109.868 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -57.7 -53.51 57.38 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 119.985 -0.686 . . . . 2.4700000000000002 110.495 176.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 572' ' ' PHE . . . . . 0.631 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 18.6 m-85 -62.44 -9.86 9.79 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.093 1.146 . . . . 1.23 114.093 -177.189 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 573' ' ' MET . . . . . 0.906 ' HB3' HD11 ' B' ' 625' ' ' LEU . 67.9 mtt -76.47 -5.26 46.7 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.637 0.732 . . . . 2.1099999999999999 109.662 178.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -109.49 -0.57 18.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.765 -1.107 . . . . 3.2000000000000002 111.492 173.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 575' ' ' GLU . . . . . 0.631 ' HG2' ' HA ' ' B' ' 572' ' ' PHE . 25.2 mm-40 -68.47 130.15 42.01 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.169 -0.469 . . . . 1.55 110.214 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 76.8 p -87.79 -21.41 25.12 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.941 0.719 . . . . 1.3999999999999999 112.941 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -60.1 128.05 34.9 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.418 0.627 . . . . 2.8500000000000001 112.584 -175.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -44.95 125.88 5.44 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.372 -0.831 . . . . 2.1499999999999999 113.103 -171.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 579' ' ' GLY . . . . . 0.415 ' O ' ' HG2' ' B' ' 583' ' ' MET . . . 96.23 -34.74 4.76 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.195 1.238 . . . . 0.0 116.195 174.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 47.1 t -53.77 -46.22 62.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.173 0.805 . . . . 1.29 113.173 -175.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -59.75 -42.27 92.87 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.333 0.494 . . . . 1.99 112.333 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -60.53 -42.46 96.55 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 112.202 0.445 . . . . 2.23 112.202 172.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 583' ' ' MET . . . . . 0.556 ' HB3' ' SD ' ' B' ' 545' ' ' MET . 28.6 mmt -60.66 -49.47 77.37 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.99 -0.284 . . . . 2.5800000000000001 110.475 175.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.97 80.32 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.197 -0.456 . . . . 0.029999999999999999 111.722 -177.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 77.5 m -74.32 -41.02 61.82 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 120.078 -0.649 . . . . 1.5 111.949 -177.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 586' ' ' ASP . . . . . 0.651 ' O ' HG22 ' B' ' 589' ' ' ILE . 69.2 m-20 -59.56 -46.3 89.3 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 116.252 -0.431 . . . . 1.98 111.984 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 587' ' ' THR . . . . . 0.413 ' OG1' ' HG3' ' B' ' 545' ' ' MET . 73.7 m -62.19 -41.22 98.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.3 110.43 175.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -61.45 -32.23 72.2 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.085 -0.507 . . . . 0.53000000000000003 111.177 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 589' ' ' ILE . . . . . 0.651 HG22 ' O ' ' B' ' 586' ' ' ASP . 10.0 tp -79.88 -35.95 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.835 -1.946 . . . . 1.97 109.74 -175.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . 0.429 ' O ' ' HE3' ' B' ' 594' ' ' LYS . 67.1 mttm -57.51 -50.02 74.44 Favored 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 107.697 -1.223 . . . . 2.6200000000000001 107.697 176.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 74.6 mt -63.76 -43.85 98.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 123.345 0.658 . . . . 1.96 112.77 -177.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.08 93.37 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.417 -0.513 . . . . 0.0 112.331 177.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -62.35 -70.14 0.22 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 119.12 -1.032 . . . . 2.3599999999999999 109.783 174.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 594' ' ' LYS . . . . . 0.586 ' HG2' ' HG2' ' B' ' 552' ' ' PRO . 0.0 OUTLIER -56.02 -23.79 35.27 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 116.69 2.107 . . . . 2.1899999999999999 116.69 -176.564 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 74.3 m -121.74 25.26 9.34 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.249 1.203 . . . . 1.26 114.249 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 596' ' ' ARG . . . . . 0.521 ' HG3' ' HD3' ' B' ' 597' ' ' ARG . 24.3 ptt180 -48.48 -38.54 20.32 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.856 1.799 . . . . 3.5800000000000001 115.856 -172.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . 0.521 ' HD3' ' HG3' ' B' ' 596' ' ' ARG . 0.5 OUTLIER -69.66 -32.53 71.24 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.225 0.824 . . . . 3.7400000000000002 113.225 -175.512 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 51.8 m-70 -70.09 -3.86 18.54 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-N 115.581 -0.736 . . . . 2.1400000000000001 112.054 -173.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -105.55 -16.93 14.57 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.613 0.571 . . . . 2.9500000000000002 110.18 -176.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 600' ' ' VAL . . . . . 0.414 HG22 ' O ' ' B' ' 597' ' ' ARG . 33.8 m -105.82 -24.41 4.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 CA-C-N 115.114 -0.948 . . . . 1.4199999999999999 111.242 -175.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 601' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 3.5 pt20 -101.95 139.49 37.51 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.56 -0.856 . . . . 2.3399999999999999 111.635 176.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 48.9 t -60.89 122.66 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 108.596 -0.89 . . . . 1.3700000000000001 108.596 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -92.67 167.3 11.99 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.649 0.593 . . . . 2.6800000000000002 110.138 -177.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 40.5 t -71.99 129.03 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 119.87 -0.732 . . . . 1.27 112.968 -175.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.31 6.6 64.45 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.096 -175.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 606' ' ' GLU . . . . . 0.505 ' HG3' ' H ' ' B' ' 608' ' ' MET . 10.5 tp10 -131.46 157.98 42.05 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.667 -0.813 . . . . 2.5099999999999998 110.841 175.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 33.9 m -103.24 -22.53 4.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.063 -0.972 . . . . 1.3999999999999999 112.507 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 608' ' ' MET . . . . . 0.505 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 52.6 ttm -136.97 142.18 37.5 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.651 0.611 . . . . 2.6800000000000002 112.651 -174.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 609' ' ' PRO . . . . . 0.499 ' HD2' ' HG3' ' B' ' 608' ' ' MET . 54.2 Cg_exo -52.11 130.96 37.28 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.89 1.06 . . . . 0.42999999999999999 112.086 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -57.03 -31.86 65.58 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 123.183 0.302 . . . . 2.3700000000000001 111.799 -174.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 611' ' ' ILE . . . . . 0.42 HG23 ' N ' ' B' ' 612' ' ' ASP . 13.4 tt -49.92 -44.97 21.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 120.816 0.341 . . . . 1.8400000000000001 110.538 178.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 612' ' ' ASP . . . . . 0.42 ' N ' HG23 ' B' ' 611' ' ' ILE . 15.0 m-20 -49.86 -52.0 36.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.612 0.765 . . . . 2.1499999999999999 112.875 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.02 -37.06 78.64 Favored 'General case' 0 C--O 1.244 0.802 0 C-N-CA 120.555 -0.458 . . . . 2.6600000000000001 110.183 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 72.6 mt -64.53 -47.93 87.1 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 120.214 -0.594 . . . . 1.76 112.002 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 93.3 mt -62.67 -31.17 72.0 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.955 0.724 . . . . 1.8400000000000001 112.955 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -79.5 2.12 23.23 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.621 1.341 . . . . 2.0600000000000001 114.621 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 617' ' ' ASN . . . . . 0.574 ' HB2' HG22 ' B' ' 620' ' ' THR . 26.2 p30 -142.44 15.62 2.01 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.168 0.803 . . . . 1.97 113.168 -174.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 618' ' ' ILE . . . . . 0.496 HG13 ' N ' ' B' ' 619' ' ' ASN . 16.7 pt -46.9 -47.02 8.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.0099999999999998 110.222 -176.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 619' ' ' ASN . . . . . 0.496 ' N ' HG13 ' B' ' 618' ' ' ILE . 7.3 t30 -63.12 -51.21 67.44 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 113.777 1.028 . . . . 2.2799999999999998 113.777 -176.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 620' ' ' THR . . . . . 0.574 HG22 ' HB2' ' B' ' 617' ' ' ASN . 4.1 t -56.82 -31.87 65.16 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 119.445 -0.902 . . . . 1.3200000000000001 110.785 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 621' ' ' ILE . . . . . 0.521 HG13 HG23 ' B' ' 622' ' ' ILE . 36.1 pt -79.26 -42.73 23.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 115.342 1.608 . . . . 2.0 115.342 -179.036 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 622' ' ' ILE . . . . . 0.737 ' HA ' HD13 ' B' ' 625' ' ' LEU . 39.5 pt -87.67 -6.32 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 115.031 1.493 . . . . 2.0899999999999999 115.031 -177.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.3 t -19.9 -58.33 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 116.642 2.09 . . . . 1.47 116.642 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -99.35 -7.53 26.11 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.028 -1.442 . . . . 2.0699999999999998 110.973 -163.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 625' ' ' LEU . . . . . 0.906 HD11 ' HB3' ' B' ' 573' ' ' MET . 9.5 mp -71.81 146.85 47.75 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.493 -0.321 . . . . 1.6699999999999999 111.748 -173.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 626' ' ' GLN . . . . . 0.455 HE21 HE22 ' B' ' 629' ' ' GLN . 24.8 mt-30 -76.73 162.09 71.69 Favored Pre-proline 0 N--CA 1.464 0.237 0 N-CA-C 108.843 -0.799 . . . . 2.3500000000000001 108.843 174.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -47.81 -43.6 28.82 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.823 1.432 . . . . 0.44 115.823 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 628' ' ' GLN . . . . . 0.612 HE21 ' HA ' ' B' ' 628' ' ' GLN . 0.0 OUTLIER -67.33 -43.0 82.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.427 -0.509 . . . . 2.6200000000000001 109.631 -174.621 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 629' ' ' GLN . . . . . 0.455 HE22 HE21 ' B' ' 626' ' ' GLN . 1.7 mp0 -63.31 -38.2 90.22 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.924 -0.58 . . . . 2.0600000000000001 110.924 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 630' ' ' VAL . . . . . 0.422 HG23 ' O ' ' B' ' 626' ' ' GLN . 90.7 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.195 -0.907 . . . . 1.3 110.615 176.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 504' ' ' ILE . . . . . 0.432 ' N ' HD13 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.339 0 N-CA-C 113.069 0.766 . . . . 2.1299999999999999 113.069 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 79.2 p -48.83 119.13 2.95 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.542 0.571 . . . . 1.29 112.542 174.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.82 1.43 67.85 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 120.926 -0.654 . . . . 0.0 114.477 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.53 41.5 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.627 0.714 . . . . 0.02 112.443 176.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 63.2 mtt -112.47 159.99 18.22 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.11 0.481 . . . . 2.21 112.221 174.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -69.79 134.25 48.34 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.061 -0.718 . . . . 2.6699999999999999 109.061 174.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -41.62 -35.48 0.76 Allowed 'General case' 0 C--O 1.241 0.623 0 N-CA-C 113.39 0.885 . . . . 2.6600000000000001 113.39 -173.283 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -73.8 -41.92 61.69 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.541 -0.754 . . . . 2.4399999999999999 112.087 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -64.88 -40.1 94.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.111 0.482 . . . . 2.0800000000000001 110.863 171.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -53.64 -48.71 69.12 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.38 -0.827 . . . . 1.9199999999999999 111.141 177.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 514' ' ' LYS . . . . . 0.541 ' O ' HG13 ' B' ' 518' ' ' VAL . 39.0 ttmt -54.88 -57.56 11.11 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 111.93 0.345 . . . . 2.73 111.93 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 515' ' ' ARG . . . . . 0.523 ' O ' HG22 ' B' ' 518' ' ' VAL . 28.2 mmm180 -56.62 -35.94 68.89 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 124.221 0.951 . . . . 3.75 111.124 -177.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.718 ' O ' HG13 ' B' ' 520' ' ' VAL . 70.8 t80 -76.08 -45.58 33.34 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.101 -0.954 . . . . 1.8899999999999999 110.515 -173.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 517' ' ' LEU . . . . . 0.748 ' HA ' HG22 ' B' ' 520' ' ' VAL . 3.1 tt -66.76 -32.24 73.41 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.755 -0.657 . . . . 1.8999999999999999 112.606 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 518' ' ' VAL . . . . . 0.541 HG13 ' O ' ' B' ' 514' ' ' LYS . 34.2 m -67.53 -35.07 72.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 118.473 -1.291 . . . . 1.3999999999999999 109.087 178.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 47.8 m -72.96 -36.35 67.13 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.295 0.569 . . . . 1.1799999999999999 112.437 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 520' ' ' VAL . . . . . 0.748 HG22 ' HA ' ' B' ' 517' ' ' LEU . 22.0 m -71.23 -42.35 74.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.418 -0.355 . . . . 1.22 111.643 -174.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 521' ' ' ILE . . . . . 0.701 HG23 HG23 ' B' ' 520' ' ' VAL . 30.5 pt -90.64 -25.75 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 115.487 1.662 . . . . 1.98 115.487 -175.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.88 -35.24 76.12 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.694 -0.854 . . . . 2.5699999999999998 108.694 173.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 523' ' ' ASP . . . . . 0.404 ' O ' ' HG ' ' B' ' 527' ' ' LEU . 18.5 t70 -92.36 -21.49 20.21 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.037 1.495 . . . . 2.1699999999999999 115.037 -177.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 524' ' ' LEU . . . . . 0.494 HD13 ' O ' ' B' ' 520' ' ' VAL . 5.2 mp -70.61 -45.33 65.46 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.305 -0.628 . . . . 1.48 109.305 168.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 44.5 tp -52.31 -45.46 65.57 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 121.236 0.541 . . . . 1.95 110.91 169.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 526' ' ' GLY . . . . . 0.458 ' O ' ' HG2' ' B' ' 529' ' ' GLU . . . -66.5 -40.56 94.33 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -178.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 527' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' B' ' 523' ' ' ASP . 74.6 mt -63.57 -36.12 82.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 1.6699999999999999 111.47 175.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 42.4 t -63.5 -47.77 80.36 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.041 -0.527 . . . . 0.58999999999999997 110.634 -175.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 529' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' B' ' 526' ' ' GLY . 10.9 pt-20 -61.58 -29.71 70.2 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.544 -0.753 . . . . 2.5 112.542 173.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -71.62 -54.74 9.43 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.375 0.88 . . . . 2.2400000000000002 113.375 -177.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -68.76 137.95 54.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.0 -0.545 . . . . 2.2799999999999998 111.07 -177.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 532' ' ' ARG . . . . . 0.405 ' HG2' ' N ' ' B' ' 533' ' ' GLY . 68.2 ttt180 -96.46 160.6 14.32 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.813 -0.631 . . . . 4.21 110.16 178.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 533' ' ' GLY . . . . . 0.405 ' N ' ' HG2' ' B' ' 532' ' ' ARG . . . 87.53 119.56 1.37 Allowed Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 115.848 -0.614 . . . . 0.0 114.007 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -47.08 -36.63 8.42 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.241 0.83 . . . . 2.9500000000000002 113.241 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -50.52 -51.92 43.3 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 120.33 -0.548 . . . . 2.2000000000000002 110.851 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 536' ' ' ASN . . . . . 0.498 ' O ' HG22 ' B' ' 539' ' ' ILE . 18.7 m120 -65.95 -44.87 83.74 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.717 0.636 . . . . 1.47 112.717 178.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 537' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -67.76 -32.04 72.36 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.408 -0.517 . . . . 2.5 110.283 -174.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.13 -46.92 69.5 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.896 -0.593 . . . . 0.040000000000000001 111.112 178.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 539' ' ' ILE . . . . . 0.498 HG22 ' O ' ' B' ' 536' ' ' ASN . 0.4 OUTLIER -58.19 -54.92 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.56 0.695 . . . . 1.8200000000000001 111.307 173.42 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 540' ' ' ILE . . . . . 0.494 ' N ' ' CG2' ' B' ' 539' ' ' ILE . 82.4 mt -56.77 -48.18 81.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.566 -178.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.38 -44.05 84.1 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 113.68 0.993 . . . . 0.02 113.68 179.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 63.4 m -60.43 -38.76 85.11 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.619 -0.432 . . . . 1.2 110.351 -178.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 543' ' ' ASN . . . . . 0.434 ' O ' HG12 ' B' ' 547' ' ' ILE . 42.1 t30 -69.0 -47.14 66.23 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.316 1.228 . . . . 2.0299999999999998 114.316 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 544' ' ' ILE . . . . . 0.402 HG12 ' HB3' ' B' ' 524' ' ' LEU . 57.6 mt -52.64 -45.96 48.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.471 -0.937 . . . . 1.8100000000000001 108.471 170.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 545' ' ' MET . . . . . 0.762 ' HB3' HG21 ' B' ' 587' ' ' THR . 50.6 mtp -64.05 -42.24 97.11 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 119.718 -0.793 . . . . 2.6000000000000001 112.828 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -58.37 -48.8 79.42 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 119.272 -0.971 . . . . 2.0800000000000001 109.829 176.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 547' ' ' ILE . . . . . 0.517 ' O ' ' HG2' ' B' ' 550' ' ' GLN . 43.2 mm -55.06 -61.36 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.854 0.687 . . . . 1.5 112.854 179.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 548' ' ' VAL . . . . . 0.617 HG22 HD11 ' B' ' 555' ' ' LEU . 12.4 p -47.41 -44.23 9.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 C-N-CA 119.892 -0.723 . . . . 1.3999999999999999 111.388 176.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.32 -28.1 58.68 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.799 -0.563 . . . . 0.0 112.916 -177.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 550' ' ' GLN . . . . . 0.517 ' HG2' ' O ' ' B' ' 547' ' ' ILE . 7.5 pt20 -87.08 -9.55 55.12 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.598 0.592 . . . . 2.27 112.598 -175.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -120.38 59.69 6.99 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.773 1.027 . . . . 3.5299999999999998 113.773 -176.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 552' ' ' PRO . . . . . 0.466 ' HD3' ' C ' ' B' ' 550' ' ' GLN . 44.6 Cg_exo -55.96 -39.35 91.72 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.068 0.509 . . . . 0.46000000000000002 113.139 177.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -56.32 -46.67 79.77 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.153 0.501 . . . . 3.8700000000000001 109.968 -174.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -48.93 -59.79 3.3 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 123.956 0.902 . . . . 0.69999999999999996 112.113 167.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 555' ' ' LEU . . . . . 0.617 HD11 HG22 ' B' ' 548' ' ' VAL . 77.4 mt -54.33 -48.6 71.2 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.281 -0.418 . . . . 1.49 110.17 -178.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . 0.44 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 46.5 ttp180 -53.91 -35.9 62.14 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.752 1.019 . . . . 3.0899999999999999 113.752 -178.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.05 -12.13 51.02 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.513 -0.475 . . . . 0.0 112.08 -177.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 558' ' ' HIS . . . . . 0.481 ' ND1' ' HB2' ' B' ' 561' ' ' PHE . 18.7 t-160 -128.28 78.45 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.399 1.259 . . . . 2.9300000000000002 114.399 -177.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 559' ' ' TRP . . . . . 0.573 ' HB2' ' NE2' ' B' ' 603' ' ' GLN . 17.2 p90 -50.39 -48.3 56.02 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 116.613 2.079 . . . . 3.1099999999999999 116.613 -176.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 24.1 ttmm -56.6 -36.69 69.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.265 -0.425 . . . . 3.3199999999999998 111.073 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 561' ' ' PHE . . . . . 0.556 ' O ' HG13 ' B' ' 565' ' ' VAL . 0.1 OUTLIER -74.91 -45.08 45.02 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.061 -1.055 . . . . 1.25 111.897 175.68 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . 0.855 ' O ' HG22 ' B' ' 565' ' ' VAL . 6.4 tt -49.94 -59.12 4.17 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 122.459 0.304 . . . . 1.3200000000000001 110.338 175.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -50.22 -38.64 41.31 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.863 1.061 . . . . 2.7400000000000002 113.863 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 37.8 m -71.81 -39.42 69.86 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.487 0.66 . . . . 1.24 110.294 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 565' ' ' VAL . . . . . 0.855 HG22 ' O ' ' B' ' 562' ' ' LEU . 4.8 m -62.85 -41.28 91.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.687 -0.688 . . . . 1.1899999999999999 112.529 173.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 566' ' ' VAL . . . . . 0.557 HG22 HD12 ' B' ' 591' ' ' ILE . 47.9 t -71.06 -50.84 39.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 C-N-CA 120.537 -0.465 . . . . 1.3600000000000001 110.798 -176.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -51.04 -37.42 45.26 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.035 -0.53 . . . . 1.9399999999999999 112.067 170.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -72.72 -32.58 65.82 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.736 -0.468 . . . . 3.5299999999999998 109.736 -179.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 569' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' B' ' 565' ' ' VAL . 71.3 mt -67.52 -36.53 81.23 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 108.648 -0.871 . . . . 2.0099999999999998 108.648 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -65.29 -39.34 92.42 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.915 -0.402 . . . . 3.77 109.915 178.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.68 -53.58 56.63 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 120.011 -0.676 . . . . 2.4700000000000002 110.465 176.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 572' ' ' PHE . . . . . 0.559 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 23.5 m-85 -62.44 -9.9 9.91 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.121 1.156 . . . . 1.23 114.121 -177.135 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 573' ' ' MET . . . . . 0.605 ' HB3' HD21 ' B' ' 625' ' ' LEU . 67.9 mtt -76.39 -5.34 46.86 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.648 0.737 . . . . 2.1099999999999999 109.641 178.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -109.43 -0.57 18.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.815 -1.084 . . . . 3.2000000000000002 111.431 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 575' ' ' GLU . . . . . 0.753 ' HB3' HG21 ' B' ' 580' ' ' VAL . 48.4 mm-40 -68.59 130.24 42.26 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 116.195 -0.457 . . . . 1.55 110.124 177.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 64.0 p -87.89 -21.21 25.1 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.026 0.75 . . . . 1.3999999999999999 113.026 -177.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 577' ' ' HIS . . . . . 0.694 ' O ' HG22 ' B' ' 580' ' ' VAL . 64.7 t-80 -60.21 128.0 34.62 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.402 0.62 . . . . 2.8500000000000001 112.528 -175.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -44.85 125.86 5.33 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.397 -0.82 . . . . 2.1499999999999999 113.139 -171.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.72 4.76 Favored Glycine 0 C--O 1.223 -0.567 0 N-CA-C 116.299 1.28 . . . . 0.0 116.299 175.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 580' ' ' VAL . . . . . 0.753 HG21 ' HB3' ' B' ' 575' ' ' GLU . 23.5 m -53.81 -46.31 63.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.096 0.776 . . . . 1.29 113.096 -175.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.495 ' N ' HG23 ' B' ' 580' ' ' VAL . 22.9 mt-30 -59.67 -42.3 92.56 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.371 0.508 . . . . 1.99 112.371 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -60.54 -42.4 96.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 112.232 0.456 . . . . 2.23 112.232 172.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 7.2 tpt -60.68 -49.51 77.21 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.084 -0.246 . . . . 2.5800000000000001 110.453 175.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.7 -43.0 80.11 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.129 -0.487 . . . . 0.029999999999999999 111.81 -177.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 50.2 t -74.35 -40.93 61.82 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.03 -0.668 . . . . 1.5 112.004 -177.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 586' ' ' ASP . . . . . 0.619 ' O ' HG22 ' B' ' 589' ' ' ILE . 0.7 OUTLIER -59.6 -46.29 89.4 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.249 -0.432 . . . . 1.98 111.974 -179.899 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 587' ' ' THR . . . . . 0.762 HG21 ' HB3' ' B' ' 545' ' ' MET . 41.7 p -62.23 -41.23 98.23 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.372 0.669 . . . . 1.3 110.358 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 588' ' ' PHE . . . . . 0.542 ' HA ' HG12 ' B' ' 591' ' ' ILE . 88.2 t80 -61.46 -32.15 72.14 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.118 -0.492 . . . . 0.53000000000000003 111.186 -177.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 589' ' ' ILE . . . . . 0.619 HG22 ' O ' ' B' ' 586' ' ' ASP . 20.1 tt -79.87 -35.95 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.878 -1.929 . . . . 1.97 109.8 -175.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -57.56 -49.86 74.99 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 107.779 -1.193 . . . . 2.6200000000000001 107.779 176.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . 0.557 HD12 HG22 ' B' ' 566' ' ' VAL . 34.5 pt -63.91 -43.64 97.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.784 0.661 . . . . 1.96 112.784 -176.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . 0.498 ' N ' HG13 ' B' ' 591' ' ' ILE . . . -63.94 -39.17 93.53 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.535 -0.466 . . . . 0.0 112.217 177.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 593' ' ' GLN . . . . . 0.495 HE21 ' HA ' ' B' ' 593' ' ' GLN . 0.0 OUTLIER -62.3 -70.14 0.22 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.14 -1.024 . . . . 2.3599999999999999 109.795 174.518 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -56.13 -23.72 36.28 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 116.623 2.082 . . . . 2.1899999999999999 116.623 -176.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 74.8 m -121.66 25.15 9.44 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 114.331 1.234 . . . . 1.26 114.331 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -48.5 -38.52 20.4 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.887 1.81 . . . . 3.5800000000000001 115.887 -172.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . 0.422 ' O ' ' HG2' ' B' ' 601' ' ' GLN . 34.5 ttm180 -69.56 -32.63 71.52 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.242 0.831 . . . . 3.7400000000000002 113.242 -175.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 598' ' ' HIS . . . . . 0.44 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 57.2 m-70 -70.07 -3.84 18.37 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.595 -0.73 . . . . 2.1400000000000001 112.107 -173.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -105.54 -16.88 14.59 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 123.597 0.561 . . . . 2.9500000000000002 110.231 -176.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 35.8 m -105.9 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.11 -0.95 . . . . 1.4199999999999999 111.276 -175.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 601' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 3.9 pt20 -102.05 139.52 37.57 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 119.563 -0.855 . . . . 2.3399999999999999 111.561 176.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 7.4 m -60.95 122.74 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.597 -0.89 . . . . 1.3700000000000001 108.597 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 603' ' ' GLN . . . . . 0.573 ' NE2' ' HB2' ' B' ' 559' ' ' TRP . 18.9 pt20 -92.79 167.31 11.95 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.631 0.582 . . . . 2.6800000000000002 110.048 -177.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 41.3 t -71.99 129.01 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 N-CA-C 112.958 0.725 . . . . 1.27 112.958 -175.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.35 6.52 64.44 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.059 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 606' ' ' GLU . . . . . 0.537 ' HG3' ' H ' ' B' ' 608' ' ' MET . 8.7 tp10 -131.44 157.97 42.06 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.639 -0.825 . . . . 2.5099999999999998 110.808 175.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 607' ' ' VAL . . . . . 0.538 HG13 ' HG2' ' B' ' 608' ' ' MET . 13.9 p -103.26 -22.46 4.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.097 -0.956 . . . . 1.3999999999999999 112.49 -175.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 608' ' ' MET . . . . . 0.538 ' HG2' HG13 ' B' ' 607' ' ' VAL . 22.2 mmt -137.02 142.22 37.57 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.601 0.593 . . . . 2.6800000000000002 112.601 -174.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 609' ' ' PRO . . . . . 0.542 ' HB2' HG22 ' B' ' 611' ' ' ILE . 9.7 Cg_endo -52.08 130.9 36.93 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.42999999999999999 112.131 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -57.0 -31.84 65.5 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 111.823 0.305 . . . . 2.3700000000000001 111.823 -174.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 611' ' ' ILE . . . . . 0.542 HG22 ' HB2' ' B' ' 609' ' ' PRO . 14.0 tt -50.0 -44.93 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 CA-C-O 120.816 0.341 . . . . 1.8400000000000001 110.496 178.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 612' ' ' ASP . . . . . 0.413 ' N ' HG23 ' B' ' 611' ' ' ILE . 20.9 t70 -49.88 -52.0 36.23 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.646 0.778 . . . . 2.1499999999999999 112.875 177.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -59.95 -37.13 78.67 Favored 'General case' 0 C--O 1.244 0.795 0 C-N-CA 120.59 -0.444 . . . . 2.6600000000000001 110.189 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 614' ' ' ILE . . . . . 0.401 ' O ' ' ND2' ' B' ' 617' ' ' ASN . 73.0 mt -64.45 -48.05 86.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 C-N-CA 120.262 -0.575 . . . . 1.76 111.973 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 59.8 tp -62.6 -31.13 71.91 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.03 0.752 . . . . 1.8400000000000001 113.03 -177.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -79.6 2.16 23.4 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.639 1.348 . . . . 2.0600000000000001 114.639 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 617' ' ' ASN . . . . . 0.606 HD22 ' C ' ' B' ' 617' ' ' ASN . 0.2 OUTLIER -142.42 15.67 2.02 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.117 0.784 . . . . 1.97 113.117 -174.283 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 618' ' ' ILE . . . . . 0.469 HG23 ' N ' ' B' ' 619' ' ' ASN . 13.5 tt -46.87 -46.98 8.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.0099999999999998 110.263 -176.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 619' ' ' ASN . . . . . 0.469 ' N ' HG23 ' B' ' 618' ' ' ILE . 22.7 p-10 -63.24 -51.06 67.74 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.754 1.02 . . . . 2.2799999999999998 113.754 -176.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 620' ' ' THR . . . . . 0.423 ' OG1' ' HB2' ' B' ' 617' ' ' ASN . 56.8 p -56.94 -31.9 65.43 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.46 -0.896 . . . . 1.3200000000000001 110.741 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 621' ' ' ILE . . . . . 0.518 HG13 HG23 ' B' ' 622' ' ' ILE . 32.0 pt -79.27 -42.65 23.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.373 1.62 . . . . 2.0 115.373 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 622' ' ' ILE . . . . . 0.518 HG23 HG13 ' B' ' 621' ' ' ILE . 34.7 pt -87.67 -6.25 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 115.069 1.507 . . . . 2.0899999999999999 115.069 -177.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 40.2 t -19.98 -58.32 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.567 2.062 . . . . 1.47 116.567 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.23 -7.65 26.16 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.037 -1.438 . . . . 2.0699999999999998 110.994 -163.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 625' ' ' LEU . . . . . 0.605 HD21 ' HB3' ' B' ' 573' ' ' MET . 82.7 mt -71.78 146.9 47.78 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 123.311 0.382 . . . . 1.6699999999999999 111.773 -173.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 626' ' ' GLN . . . . . 0.531 ' HB3' ' HD2' ' B' ' 627' ' ' PRO . 97.2 mt-30 -76.75 162.1 71.64 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 108.827 -0.805 . . . . 2.3500000000000001 108.827 174.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 627' ' ' PRO . . . . . 0.531 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 6.3 Cg_endo -47.85 -43.55 29.14 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.823 1.432 . . . . 0.44 115.823 -178.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -67.32 -43.08 82.52 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.615 -0.513 . . . . 2.6200000000000001 109.615 -174.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -63.29 -38.29 90.58 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.951 -0.568 . . . . 2.0600000000000001 110.9 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 630' ' ' VAL . . . . . 0.459 HG23 ' O ' ' B' ' 626' ' ' GLN . 80.9 t . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.237 -0.887 . . . . 1.3 110.67 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 504' ' ' ILE . . . . . 0.461 ' N ' HD13 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.277 0 N-CA-C 113.094 0.776 . . . . 2.1299999999999999 113.094 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 74.9 m -48.84 119.11 2.94 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.519 0.563 . . . . 1.29 112.519 174.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.79 1.5 67.86 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 120.948 -0.644 . . . . 0.0 114.501 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.4 -7.57 41.21 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 117.549 0.674 . . . . 0.02 112.444 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 24.8 mmt -112.43 159.98 18.2 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.22 0.533 . . . . 2.21 112.262 174.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -69.64 134.28 48.53 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 109.051 -0.722 . . . . 2.6699999999999999 109.051 174.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.78 -35.39 0.79 Allowed 'General case' 0 C--O 1.239 0.533 0 N-CA-C 113.37 0.878 . . . . 2.6600000000000001 113.37 -173.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -73.82 -41.88 61.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.531 -0.759 . . . . 2.4399999999999999 112.1 -176.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -64.85 -40.18 94.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.182 0.515 . . . . 2.0800000000000001 110.873 171.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -53.7 -48.61 69.38 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.285 -0.87 . . . . 1.9199999999999999 111.107 177.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 514' ' ' LYS . . . . . 0.431 ' HE2' ' NE2' ' B' ' 558' ' ' HIS . 9.9 mtpm? -54.86 -57.67 10.66 Favored 'General case' 0 C--O 1.241 0.65 0 N-CA-C 111.889 0.329 . . . . 2.73 111.889 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 515' ' ' ARG . . . . . 0.445 ' O ' HG23 ' B' ' 519' ' ' THR . 74.5 mtp180 -56.63 -35.85 68.81 Favored 'General case' 0 CA--C 1.504 -0.817 0 O-C-N 124.129 0.893 . . . . 3.75 111.138 -177.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -76.15 -45.63 32.62 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.151 -0.932 . . . . 1.8899999999999999 110.515 -173.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 517' ' ' LEU . . . . . 0.622 ' HA ' HG12 ' B' ' 520' ' ' VAL . 8.2 tt -66.68 -32.26 73.46 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.761 -0.654 . . . . 1.8999999999999999 112.64 177.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 518' ' ' VAL . . . . . . . . . . . . . 44.6 t -67.47 -35.1 72.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 118.515 -1.274 . . . . 1.3999999999999999 109.081 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 519' ' ' THR . . . . . 0.445 HG23 ' O ' ' B' ' 515' ' ' ARG . 75.9 p -72.93 -36.42 67.22 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.451 0.643 . . . . 1.1799999999999999 112.42 178.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 520' ' ' VAL . . . . . 0.638 HG13 HG23 ' B' ' 521' ' ' ILE . 9.8 p -71.18 -42.36 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 O-C-N 122.094 -0.379 . . . . 1.22 111.673 -174.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 521' ' ' ILE . . . . . 0.638 HG23 HG13 ' B' ' 520' ' ' VAL . 26.2 pt -90.64 -25.8 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.442 1.645 . . . . 1.98 115.442 -175.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -60.82 -35.21 75.95 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.657 -0.868 . . . . 2.5699999999999998 108.657 173.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 523' ' ' ASP . . . . . 0.457 ' O ' HD23 ' B' ' 527' ' ' LEU . 10.0 m-20 -92.43 -21.46 20.18 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.987 1.477 . . . . 2.1699999999999999 114.987 -177.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 524' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' B' ' 520' ' ' VAL . 84.3 mt -70.6 -45.46 65.27 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 109.275 -0.639 . . . . 1.48 109.275 169.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . 0.683 HD22 HD13 ' B' ' 544' ' ' ILE . 3.7 mm? -52.16 -45.46 65.08 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.28 0.562 . . . . 1.95 110.97 169.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.5 -40.59 94.34 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 -178.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 527' ' ' LEU . . . . . 0.457 HD23 ' O ' ' B' ' 523' ' ' ASP . 2.5 mm? -63.57 -36.12 82.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 1.6699999999999999 111.47 175.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 528' ' ' CYS . . . . . 0.406 ' HA ' HG21 ' B' ' 540' ' ' ILE . 44.1 t -63.55 -47.6 80.9 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.041 -0.527 . . . . 0.58999999999999997 110.709 -175.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -61.78 -29.57 70.23 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.518 -0.764 . . . . 2.5 112.585 173.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -71.64 -54.76 9.35 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.358 0.873 . . . . 2.2400000000000002 113.358 -177.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -68.77 137.97 54.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.97 -0.559 . . . . 2.2799999999999998 111.002 -177.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 532' ' ' ARG . . . . . 0.434 ' HG2' ' N ' ' B' ' 533' ' ' GLY . 52.6 ttt180 -96.43 160.74 14.25 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.773 -0.649 . . . . 4.21 110.208 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 533' ' ' GLY . . . . . 0.434 ' N ' ' HG2' ' B' ' 532' ' ' ARG . . . 87.46 119.63 1.36 Allowed Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 115.982 -0.554 . . . . 0.0 113.954 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 534' ' ' LYS . . . . . 0.731 ' HD3' ' H ' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.04 -36.72 8.31 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.172 0.804 . . . . 2.9500000000000002 113.172 177.234 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -50.61 -51.8 45.33 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.868 -0.52 . . . . 2.2000000000000002 110.809 174.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 536' ' ' ASN . . . . . 0.581 ' O ' HG22 ' B' ' 539' ' ' ILE . 40.0 m-80 -66.13 -44.77 83.26 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.603 0.594 . . . . 1.47 112.603 178.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 537' ' ' LYS . . . . . 0.565 ' HA ' HG22 ' B' ' 540' ' ' ILE . 96.8 mttt -67.88 -31.95 72.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.427 -0.509 . . . . 2.5 110.331 -174.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.08 -46.97 69.53 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.822 -0.626 . . . . 0.040000000000000001 111.149 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 539' ' ' ILE . . . . . 0.581 HG22 ' O ' ' B' ' 536' ' ' ASN . 10.2 tp -58.1 -54.99 24.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 121.542 0.687 . . . . 1.8200000000000001 111.26 173.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 540' ' ' ILE . . . . . 0.565 HG22 ' HA ' ' B' ' 537' ' ' LYS . 10.0 tp -56.83 -48.07 81.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 121.672 -0.642 . . . . 1.8500000000000001 110.581 -178.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 541' ' ' ALA . . . . . 0.427 ' N ' HG23 ' B' ' 540' ' ' ILE . . . -57.55 -44.03 84.9 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 113.545 0.943 . . . . 0.02 113.545 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 542' ' ' SER . . . . . 0.478 ' HA ' ' HG2' ' B' ' 583' ' ' MET . 96.0 p -60.47 -38.72 85.14 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.625 -0.43 . . . . 1.2 110.297 -178.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 543' ' ' ASN . . . . . 0.45 ' O ' HG12 ' B' ' 547' ' ' ILE . 27.4 t-20 -69.08 -47.08 66.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 114.339 1.237 . . . . 2.0299999999999998 114.339 -175.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 544' ' ' ILE . . . . . 0.683 HD13 HD22 ' B' ' 525' ' ' LEU . 45.2 mt -52.71 -45.88 49.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.479 -0.934 . . . . 1.8100000000000001 108.479 170.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 545' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -64.02 -42.32 97.14 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.778 -0.769 . . . . 2.6000000000000001 112.766 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -58.33 -48.81 79.34 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 119.234 -0.986 . . . . 2.0800000000000001 109.845 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 547' ' ' ILE . . . . . 0.45 HG12 ' O ' ' B' ' 543' ' ' ASN . 44.8 mm -55.06 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.77 0.656 . . . . 1.5 112.77 179.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 548' ' ' VAL . . . . . 0.526 HG12 HD11 ' B' ' 555' ' ' LEU . 86.4 t -47.37 -44.22 8.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 C-N-CA 119.837 -0.745 . . . . 1.3999999999999999 111.454 176.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.41 -28.08 58.9 Favored Glycine 0 C--O 1.237 0.319 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -87.06 -9.48 55.35 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.571 0.582 . . . . 2.27 112.571 -175.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -120.4 59.64 7.0 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 113.79 1.033 . . . . 3.5299999999999998 113.79 -176.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -56.04 -39.3 92.05 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 O-C-N 122.189 0.573 . . . . 0.46000000000000002 113.132 178.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -56.39 -46.66 80.01 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 121.074 0.464 . . . . 3.8700000000000001 109.924 -174.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -48.9 -59.75 3.33 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 123.896 0.879 . . . . 0.69999999999999996 112.125 167.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 555' ' ' LEU . . . . . 0.607 ' HB3' HD13 ' B' ' 562' ' ' LEU . 83.8 mt -54.38 -48.58 71.36 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.304 -0.407 . . . . 1.49 110.158 -178.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . 0.472 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 76.8 ttt180 -53.83 -35.91 61.97 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 113.814 1.042 . . . . 3.0899999999999999 113.814 -178.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.09 -12.13 50.91 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.486 -0.486 . . . . 0.0 112.08 -177.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 558' ' ' HIS . . . . . 0.431 ' NE2' ' HE2' ' B' ' 514' ' ' LYS . 94.7 m-70 -128.28 78.48 1.84 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.405 1.261 . . . . 2.9300000000000002 114.405 -177.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 559' ' ' TRP . . . . . 0.599 ' HB2' HE21 ' B' ' 603' ' ' GLN . 38.8 p90 -50.55 -48.25 57.48 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.505 2.039 . . . . 3.1099999999999999 116.505 -176.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.66 -36.62 69.76 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.378 -0.374 . . . . 3.3199999999999998 111.132 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 561' ' ' PHE . . . . . 0.465 ' O ' HG23 ' B' ' 565' ' ' VAL . 0.6 OUTLIER -74.9 -45.13 44.83 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 119.16 -1.016 . . . . 1.25 111.952 175.575 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . 0.607 HD13 ' HB3' ' B' ' 555' ' ' LEU . 58.5 tp -49.94 -59.22 4.07 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 122.428 0.291 . . . . 1.3200000000000001 110.264 174.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -50.11 -38.73 40.23 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.835 1.05 . . . . 2.7400000000000002 113.835 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 87.4 m -71.75 -39.35 70.09 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.553 0.692 . . . . 1.24 110.429 -176.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 565' ' ' VAL . . . . . 0.465 HG11 HG11 ' B' ' 548' ' ' VAL . 67.2 t -62.92 -41.15 91.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.618 -0.719 . . . . 1.1899999999999999 112.551 173.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 566' ' ' VAL . . . . . 0.478 HG23 ' O ' ' B' ' 562' ' ' LEU . 43.1 t -71.08 -50.89 39.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 120.546 -0.462 . . . . 1.3600000000000001 110.819 -176.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 567' ' ' ASN . . . . . 0.404 ' O ' ' HG2' ' B' ' 571' ' ' GLU . 3.7 t-20 -51.1 -37.39 45.58 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.951 -0.568 . . . . 1.9399999999999999 112.029 170.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -72.6 -32.77 66.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.67 -0.493 . . . . 3.5299999999999998 109.67 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 569' ' ' LEU . . . . . 0.84 HD11 ' O ' ' B' ' 584' ' ' ALA . 1.8 tm? -67.44 -36.46 81.26 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.739 -0.837 . . . . 2.0099999999999998 108.739 177.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 570' ' ' PHE . . . . . 0.439 ' CE2' HG12 ' B' ' 566' ' ' VAL . 24.6 m-85 -65.41 -39.31 92.0 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.863 -0.421 . . . . 3.77 109.863 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' B' ' 567' ' ' ASN . 18.7 mm-40 -57.67 -53.56 56.78 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 119.908 -0.717 . . . . 2.4700000000000002 110.479 176.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -62.36 -10.03 10.02 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.108 1.151 . . . . 1.23 114.108 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 573' ' ' MET . . . . . 0.794 ' HB3' HD11 ' B' ' 625' ' ' LEU . 18.0 mtm -76.35 -5.34 46.74 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.616 0.722 . . . . 2.1099999999999999 109.641 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 29.6 m-70 -109.42 -0.61 18.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.815 -1.084 . . . . 3.2000000000000002 111.452 173.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 575' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -68.51 130.2 42.18 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.212 -0.449 . . . . 1.55 110.083 177.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 7.9 t -87.81 -21.32 25.14 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.027 0.751 . . . . 1.3999999999999999 113.027 -177.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -60.19 128.02 34.71 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.409 0.623 . . . . 2.8500000000000001 112.532 -175.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -44.89 125.91 5.4 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.315 -0.857 . . . . 2.1499999999999999 113.011 -171.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.76 4.74 Favored Glycine 0 C--O 1.222 -0.643 0 N-CA-C 116.323 1.289 . . . . 0.0 116.323 174.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 45.2 t -53.72 -46.37 62.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 113.186 0.81 . . . . 1.29 113.186 -175.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.578 ' HB2' HE22 ' B' ' 629' ' ' GLN . 3.3 pt20 -59.63 -42.31 92.43 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.384 0.513 . . . . 1.99 112.384 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -60.46 -42.45 96.22 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.168 0.433 . . . . 2.23 112.168 172.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 583' ' ' MET . . . . . 0.478 ' HG2' ' HA ' ' B' ' 542' ' ' SER . 37.1 tpp -60.74 -49.42 77.59 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 121.027 -0.269 . . . . 2.5800000000000001 110.431 175.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 584' ' ' ALA . . . . . 0.84 ' O ' HD11 ' B' ' 569' ' ' LEU . . . -56.85 -42.96 80.65 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.162 -0.472 . . . . 0.029999999999999999 111.692 -177.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 52.6 t -74.36 -40.93 61.8 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 120.041 -0.664 . . . . 1.5 111.943 -177.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 586' ' ' ASP . . . . . 0.632 ' O ' HG22 ' B' ' 589' ' ' ILE . 15.5 t70 -59.7 -46.26 89.63 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.312 -0.404 . . . . 1.98 111.935 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 46.8 m -62.15 -41.23 98.09 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.433 0.693 . . . . 1.3 110.39 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -61.5 -32.17 72.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.075 -0.511 . . . . 0.53000000000000003 111.142 -177.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 589' ' ' ILE . . . . . 0.632 HG22 ' O ' ' B' ' 586' ' ' ASP . 8.9 tp -79.95 -35.91 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.847 -1.941 . . . . 1.97 109.854 -175.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . 0.457 ' HB3' ' NZ ' ' B' ' 590' ' ' LYS . 3.7 mmmp? -57.46 -49.99 74.49 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 107.747 -1.205 . . . . 2.6200000000000001 107.747 176.025 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 87.8 mt -63.83 -43.76 97.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.725 -0.671 . . . . 1.96 112.739 -176.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.14 93.45 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.512 -0.475 . . . . 0.0 112.244 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -62.26 -70.19 0.21 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.222 -0.991 . . . . 2.3599999999999999 109.796 174.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -56.1 -23.86 36.72 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.562 2.06 . . . . 2.1899999999999999 116.562 -176.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 75.0 m -121.68 25.24 9.38 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.261 1.208 . . . . 1.26 114.261 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -48.48 -38.54 20.32 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.861 1.8 . . . . 3.5800000000000001 115.861 -172.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -69.56 -32.66 71.57 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.186 0.809 . . . . 3.7400000000000002 113.186 -175.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 598' ' ' HIS . . . . . 0.472 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 55.1 m-70 -70.12 -3.85 18.6 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.617 -0.72 . . . . 2.1400000000000001 112.072 -173.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -105.58 -16.93 14.57 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.585 0.553 . . . . 2.9500000000000002 110.228 -176.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 46.5 t -105.82 -24.39 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.017 -0.992 . . . . 1.4199999999999999 111.295 -175.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -101.99 139.5 37.54 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.547 -0.861 . . . . 2.3399999999999999 111.599 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 4.3 p -60.91 122.7 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 N-CA-C 108.599 -0.889 . . . . 1.3700000000000001 108.599 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 603' ' ' GLN . . . . . 0.599 HE21 ' HB2' ' B' ' 559' ' ' TRP . 5.1 mt-30 -92.68 167.3 11.99 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.706 0.629 . . . . 2.6800000000000002 110.138 -177.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.01 129.08 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 C-N-CA 119.881 -0.728 . . . . 1.27 112.907 -175.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.26 6.58 64.55 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.069 -175.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 606' ' ' GLU . . . . . 0.555 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.1 tp10 -131.46 158.03 41.92 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.611 -0.836 . . . . 2.5099999999999998 110.78 175.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 33.3 m -103.24 -22.58 4.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.13 -0.941 . . . . 1.3999999999999999 112.582 -175.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 608' ' ' MET . . . . . 0.555 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 23.2 ptt? -136.92 142.25 37.89 Favored Pre-proline 0 C--O 1.223 -0.297 0 N-CA-C 112.611 0.597 . . . . 2.6800000000000002 112.611 -174.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.08 130.89 36.92 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.42999999999999999 112.131 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 610' ' ' PHE . . . . . 0.459 ' CE2' HD11 ' B' ' 614' ' ' ILE . 16.5 t80 -57.01 -31.87 65.55 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.792 0.293 . . . . 2.3700000000000001 111.792 -174.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 611' ' ' ILE . . . . . 0.403 HG23 ' N ' ' B' ' 612' ' ' ASP . 11.8 tt -50.05 -44.8 22.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.85 0.357 . . . . 1.8400000000000001 110.56 178.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 612' ' ' ASP . . . . . 0.403 ' N ' HG23 ' B' ' 611' ' ' ILE . 16.7 t70 -49.92 -52.01 36.57 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.623 0.769 . . . . 2.1499999999999999 112.906 177.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -59.84 -37.17 78.47 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 120.604 -0.438 . . . . 2.6600000000000001 110.223 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 614' ' ' ILE . . . . . 0.459 HD11 ' CE2' ' B' ' 610' ' ' PHE . 31.9 mm -64.55 -47.98 86.87 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.181 -0.607 . . . . 1.76 111.922 178.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 8.4 tt -62.63 -31.11 71.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.98 0.733 . . . . 1.8400000000000001 112.98 -177.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -79.57 2.15 23.36 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.61 1.337 . . . . 2.0600000000000001 114.61 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -142.41 15.66 2.02 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 113.103 0.779 . . . . 1.97 113.103 -174.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 618' ' ' ILE . . . . . 0.502 ' N ' HD13 ' B' ' 618' ' ' ILE . 0.2 OUTLIER -47.0 -46.98 8.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 C-N-CA 118.957 -1.097 . . . . 2.0099999999999998 110.183 -176.663 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 619' ' ' ASN . . . . . 0.494 ' N ' HG12 ' B' ' 618' ' ' ILE . 6.0 p30 -63.19 -51.11 67.65 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.759 1.022 . . . . 2.2799999999999998 113.759 -176.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 76.3 p -56.85 -31.88 65.23 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 119.449 -0.9 . . . . 1.3200000000000001 110.804 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 621' ' ' ILE . . . . . 0.548 HG13 HG12 ' B' ' 622' ' ' ILE . 42.0 pt -79.35 -42.62 23.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.322 1.601 . . . . 2.0 115.322 -179.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 622' ' ' ILE . . . . . 0.694 ' HA ' HD13 ' B' ' 625' ' ' LEU . 19.7 mm -87.72 -6.26 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 115.035 1.494 . . . . 2.0899999999999999 115.035 -177.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.6 t -19.98 -58.29 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.567 2.062 . . . . 1.47 116.567 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -99.27 -7.58 26.18 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.063 -1.426 . . . . 2.0699999999999998 111.022 -163.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 625' ' ' LEU . . . . . 0.794 HD11 ' HB3' ' B' ' 573' ' ' MET . 8.3 mp -71.83 146.82 47.74 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.409 -0.36 . . . . 1.6699999999999999 111.7 -173.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 626' ' ' GLN . . . . . 0.724 ' O ' HG13 ' B' ' 630' ' ' VAL . 18.9 pt20 -76.65 162.13 71.68 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 108.814 -0.81 . . . . 2.3500000000000001 108.814 174.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 627' ' ' PRO . . . . . 0.787 ' O ' HG22 ' B' ' 630' ' ' VAL . 79.4 Cg_exo -47.96 -43.51 29.86 Favored 'Trans proline' 0 C--O 1.233 0.263 0 N-CA-C 115.827 1.434 . . . . 0.44 115.827 -178.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 628' ' ' GLN . . . . . 0.455 ' NE2' ' HB2' ' B' ' 627' ' ' PRO . 2.0 mp0 -67.33 -43.01 82.65 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.602 -0.518 . . . . 2.6200000000000001 109.602 -174.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 629' ' ' GLN . . . . . 0.578 HE22 ' HB2' ' B' ' 581' ' ' GLN . 28.9 mt-30 -63.23 -38.34 90.8 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.944 -0.571 . . . . 2.0600000000000001 110.928 178.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 630' ' ' VAL . . . . . 0.787 HG22 ' O ' ' B' ' 627' ' ' PRO . 1.0 OUTLIER . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.213 -0.898 . . . . 1.3 110.669 176.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 504' ' ' ILE . . . . . 0.939 HG13 ' HB3' ' B' ' 507' ' ' ALA . 8.0 tp . . . . . 0 C--O 1.236 0.342 0 N-CA-C 112.985 0.735 . . . . 2.1299999999999999 112.985 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 505' ' ' SER . . . . . 0.439 ' HB3' ' HG2' ' B' ' 550' ' ' GLN . 79.5 p -48.9 119.16 3.0 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.553 0.575 . . . . 1.29 112.553 174.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.86 1.38 67.78 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.92 -0.657 . . . . 0.0 114.407 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 507' ' ' ALA . . . . . 0.939 ' HB3' HG13 ' B' ' 504' ' ' ILE . . . -94.26 -7.6 41.55 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 117.677 0.738 . . . . 0.02 112.48 176.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 26.4 mmt -112.47 159.93 18.27 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.107 -0.497 . . . . 2.21 112.269 174.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 509' ' ' HIS . . . . . 0.405 ' HD2' ' HB2' ' B' ' 511' ' ' GLU . 82.3 t60 -69.7 134.24 48.43 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 109.14 -0.689 . . . . 2.6699999999999999 109.14 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 510' ' ' GLU . . . . . 0.486 ' HG2' ' HE2' ' B' ' 514' ' ' LYS . 40.6 tt0 -41.65 -35.43 0.76 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 113.375 0.88 . . . . 2.6600000000000001 113.375 -173.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 511' ' ' GLU . . . . . 0.405 ' HB2' ' HD2' ' B' ' 509' ' ' HIS . 0.6 OUTLIER -73.73 -42.03 61.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.621 -0.718 . . . . 2.4399999999999999 112.118 -176.587 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -64.84 -40.1 94.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.129 0.49 . . . . 2.0800000000000001 110.855 171.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 513' ' ' GLU . . . . . 0.411 ' O ' ' HG ' ' B' ' 517' ' ' LEU . 36.4 tt0 -53.72 -48.65 69.39 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.369 -0.832 . . . . 1.9199999999999999 111.183 177.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 514' ' ' LYS . . . . . 0.487 ' O ' HG23 ' B' ' 518' ' ' VAL . 66.3 mttm -54.84 -57.56 11.1 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 111.93 0.345 . . . . 2.73 111.93 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -56.66 -35.84 68.86 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 124.157 0.911 . . . . 3.75 111.116 -177.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -76.26 -45.51 32.35 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.121 -0.945 . . . . 1.8899999999999999 110.502 -173.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 517' ' ' LEU . . . . . 0.608 ' HA ' HG12 ' B' ' 520' ' ' VAL . 91.0 mt -66.77 -32.25 73.41 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.757 -0.656 . . . . 1.8999999999999999 112.596 177.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 518' ' ' VAL . . . . . 0.487 HG23 ' O ' ' B' ' 514' ' ' LYS . 78.5 t -67.45 -35.15 72.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 118.495 -1.282 . . . . 1.3999999999999999 109.021 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 41.4 p -72.98 -36.26 67.04 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.311 0.577 . . . . 1.1799999999999999 112.401 178.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 520' ' ' VAL . . . . . 0.608 HG12 ' HA ' ' B' ' 517' ' ' LEU . 9.3 p -71.3 -42.37 74.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 116.48 -0.327 . . . . 1.22 111.588 -174.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 521' ' ' ILE . . . . . 0.617 HG22 ' CD1' ' B' ' 547' ' ' ILE . 15.5 pt -90.57 -25.82 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 115.455 1.65 . . . . 1.98 115.455 -175.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 34.1 ttmt -60.89 -35.16 75.91 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.682 -0.858 . . . . 2.5699999999999998 108.682 173.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -92.45 -21.49 20.15 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 114.988 1.477 . . . . 2.1699999999999999 114.988 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 77.5 mt -70.6 -45.36 65.44 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.295 -0.631 . . . . 1.48 109.295 168.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 83.9 mt -52.3 -45.45 65.54 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.222 0.534 . . . . 1.95 110.942 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.5 -40.54 94.34 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 73.4 mt -63.52 -36.18 82.94 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.033 0.444 . . . . 1.6699999999999999 111.437 175.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 42.3 t -63.47 -47.83 80.19 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.082 -0.508 . . . . 0.58999999999999997 110.63 -175.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.64 -29.6 70.16 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.438 -0.801 . . . . 2.5 112.616 173.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -71.72 -54.65 9.59 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.341 0.867 . . . . 2.2400000000000002 113.341 -177.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 17.1 tptp -68.76 137.95 54.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.008 -0.542 . . . . 2.2799999999999998 111.031 -177.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 532' ' ' ARG . . . . . 0.434 ' HA ' ' NZ ' ' B' ' 537' ' ' LYS . 16.3 ptp180 -96.43 160.72 14.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.765 -0.652 . . . . 4.21 110.19 178.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.39 119.58 1.34 Allowed Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.918 -0.583 . . . . 0.0 114.018 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -46.99 -36.71 8.07 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.187 0.81 . . . . 2.9500000000000002 113.187 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -50.53 -51.86 43.95 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 120.337 -0.545 . . . . 2.2000000000000002 110.799 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 -66.09 -44.82 83.3 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.621 0.601 . . . . 1.47 112.621 178.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 537' ' ' LYS . . . . . 0.434 ' NZ ' ' HA ' ' B' ' 532' ' ' ARG . 63.1 mttp -67.8 -32.08 72.39 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.468 -0.493 . . . . 2.5 110.258 -174.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.1 -46.93 69.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.835 -0.62 . . . . 0.040000000000000001 111.117 178.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 45.4 mm -58.15 -54.97 25.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 121.622 0.725 . . . . 1.8200000000000001 111.315 173.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 540' ' ' ILE . . . . . . . . . . . . . 82.8 mt -56.73 -48.19 81.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.663 -0.648 . . . . 1.8500000000000001 110.592 -178.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.43 -44.05 84.35 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.577 0.954 . . . . 0.02 113.577 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 542' ' ' SER . . . . . 0.436 ' HA ' ' HG2' ' B' ' 583' ' ' MET . 88.9 p -60.5 -38.78 85.43 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.571 -0.451 . . . . 1.2 110.297 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -68.96 -47.09 66.5 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.407 1.262 . . . . 2.0299999999999998 114.407 -175.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 544' ' ' ILE . . . . . 0.49 ' O ' HG12 ' B' ' 547' ' ' ILE . 61.2 mt -52.67 -45.89 49.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.539 -0.912 . . . . 1.8100000000000001 108.539 170.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 545' ' ' MET . . . . . 0.837 ' HB3' HG21 ' B' ' 587' ' ' THR . 0.2 OUTLIER -64.08 -42.31 97.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.693 -0.803 . . . . 2.6000000000000001 112.825 179.389 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -58.19 -48.84 79.06 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 119.197 -1.001 . . . . 2.0800000000000001 109.962 176.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 547' ' ' ILE . . . . . 0.617 ' CD1' HG22 ' B' ' 521' ' ' ILE . 38.1 pt -55.02 -61.43 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.856 0.687 . . . . 1.5 112.856 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 548' ' ' VAL . . . . . 0.446 HG12 ' HA ' ' B' ' 545' ' ' MET . 10.2 p -47.3 -44.26 8.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 C-N-CA 119.784 -0.767 . . . . 1.3999999999999999 111.446 176.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.37 -28.07 58.8 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.823 -0.548 . . . . 0.0 112.976 -177.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 550' ' ' GLN . . . . . 0.439 ' HG2' ' HB3' ' B' ' 505' ' ' SER . 47.3 tt0 -87.01 -9.55 55.27 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 112.601 0.593 . . . . 2.27 112.601 -175.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -120.48 59.72 7.2 Favored Pre-proline 0 CA--C 1.536 0.44 0 N-CA-C 113.792 1.034 . . . . 3.5299999999999998 113.792 -176.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -55.97 -39.34 91.78 Favored 'Trans proline' 0 C--O 1.222 -0.311 0 O-C-N 122.122 0.538 . . . . 0.46000000000000002 113.246 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 17.0 tpp180 -56.35 -46.66 79.88 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 121.022 0.439 . . . . 3.8700000000000001 109.88 -174.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -49.0 -59.69 3.4 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 123.967 0.907 . . . . 0.69999999999999996 112.098 168.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 555' ' ' LEU . . . . . 0.401 ' HG ' ' CB ' ' B' ' 562' ' ' LEU . 4.7 tp -54.33 -48.64 71.15 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 116.272 -0.422 . . . . 1.49 110.219 -179.015 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . 0.597 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 64.9 ttt180 -53.84 -35.93 62.01 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 113.739 1.015 . . . . 3.0899999999999999 113.739 -178.228 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.06 -12.16 50.89 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.486 -0.486 . . . . 0.0 112.047 -177.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -128.24 78.56 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 2.9300000000000002 114.388 -177.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.57 -48.25 57.59 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.55 2.055 . . . . 3.1099999999999999 116.55 -176.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 560' ' ' LYS . . . . . 0.459 ' O ' HG23 ' B' ' 564' ' ' THR . 75.6 mmtt -56.68 -36.65 69.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 3.3199999999999998 111.121 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 561' ' ' PHE . . . . . 0.457 ' O ' HG23 ' B' ' 565' ' ' VAL . 1.2 t80 -74.82 -45.09 45.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.142 -1.023 . . . . 1.25 112.009 175.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . 0.532 HD21 ' HE1' ' B' ' 599' ' ' PHE . 9.6 tt -50.07 -59.04 4.29 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.597 -0.274 . . . . 1.3200000000000001 110.306 175.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -50.26 -38.62 41.78 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.805 1.039 . . . . 2.7400000000000002 113.805 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 564' ' ' THR . . . . . 0.459 HG23 ' O ' ' B' ' 560' ' ' LYS . 26.1 p -71.76 -39.43 70.01 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.534 0.683 . . . . 1.24 110.38 -176.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 565' ' ' VAL . . . . . 0.457 HG23 ' O ' ' B' ' 561' ' ' PHE . 95.7 t -62.8 -41.37 92.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.577 -0.738 . . . . 1.1899999999999999 112.511 173.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 566' ' ' VAL . . . . . 0.559 HG22 HD12 ' B' ' 591' ' ' ILE . 46.3 t -70.99 -50.87 39.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 120.621 -0.432 . . . . 1.3600000000000001 110.795 -176.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -51.11 -37.43 45.93 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.075 -0.511 . . . . 1.9399999999999999 111.987 170.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -72.67 -32.63 65.96 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.733 -0.469 . . . . 3.5299999999999998 109.733 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 569' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' B' ' 565' ' ' VAL . 54.1 mt -67.51 -36.47 81.11 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 108.703 -0.851 . . . . 2.0099999999999998 108.703 177.072 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 570' ' ' PHE . . . . . 0.456 ' HD1' HG23 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.39 -39.43 92.21 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.851 -0.425 . . . . 3.77 109.851 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -57.52 -53.64 55.89 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 119.97 -0.692 . . . . 2.4700000000000002 110.52 176.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -62.36 -9.99 9.9 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 114.092 1.145 . . . . 1.23 114.092 -177.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 573' ' ' MET . . . . . 0.842 ' HB3' HD21 ' B' ' 625' ' ' LEU . 89.5 mtp -76.35 -5.37 46.84 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.614 0.721 . . . . 2.1099999999999999 109.641 178.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 60.6 m80 -109.39 -0.59 18.92 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.78 -1.1 . . . . 3.2000000000000002 111.465 173.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 575' ' ' GLU . . . . . 0.616 ' CG ' HG11 ' B' ' 580' ' ' VAL . 8.1 tp10 -68.46 130.18 42.11 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.193 -0.458 . . . . 1.55 110.162 177.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 72.4 p -87.84 -21.35 25.08 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 112.991 0.737 . . . . 1.3999999999999999 112.991 -177.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 577' ' ' HIS . . . . . 0.781 ' O ' HG12 ' B' ' 580' ' ' VAL . 11.8 t60 -60.2 128.03 34.76 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.364 0.602 . . . . 2.8500000000000001 112.596 -175.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -44.9 125.88 5.4 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.388 -0.824 . . . . 2.1499999999999999 113.103 -171.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.19 -34.65 4.81 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 116.207 1.243 . . . . 0.0 116.207 174.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 580' ' ' VAL . . . . . 0.781 HG12 ' O ' ' B' ' 577' ' ' HIS . 13.4 p -53.75 -46.34 62.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.154 0.798 . . . . 1.29 113.154 -175.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.525 ' N ' HG13 ' B' ' 580' ' ' VAL . 10.9 pt20 -59.67 -42.29 92.56 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.365 0.506 . . . . 1.99 112.365 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -60.56 -42.36 96.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 112.243 0.461 . . . . 2.23 112.243 172.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 583' ' ' MET . . . . . 0.436 ' HG2' ' HA ' ' B' ' 542' ' ' SER . 40.0 tpp -60.71 -49.45 77.47 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 121.126 -0.229 . . . . 2.5800000000000001 110.432 175.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.83 -43.06 80.68 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.196 -0.456 . . . . 0.029999999999999999 111.634 -177.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 52.2 t -74.32 -40.92 61.9 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 119.997 -0.681 . . . . 1.5 112.025 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -59.55 -46.41 88.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.415 . . . . 1.98 111.886 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 587' ' ' THR . . . . . 0.837 HG21 ' HB3' ' B' ' 545' ' ' MET . 81.4 p -62.16 -41.22 98.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.3 110.43 175.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 588' ' ' PHE . . . . . 0.545 ' HA ' HG12 ' B' ' 591' ' ' ILE . 88.7 t80 -61.5 -32.09 72.11 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.085 -0.507 . . . . 0.53000000000000003 111.189 -177.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 589' ' ' ILE . . . . . . . . . . . . . 48.5 mm -79.99 -35.87 16.4 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.89 -1.924 . . . . 1.97 109.806 -175.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -57.56 -50.01 74.5 Favored 'General case' 0 C--O 1.221 -0.438 0 N-CA-C 107.756 -1.201 . . . . 2.6200000000000001 107.756 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . 0.559 HD12 HG22 ' B' ' 566' ' ' VAL . 37.1 pt -63.74 -43.72 98.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.688 -0.687 . . . . 1.96 112.802 -177.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . 0.491 ' N ' HG13 ' B' ' 591' ' ' ILE . . . -63.96 -39.13 93.43 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.494 -0.482 . . . . 0.0 112.261 177.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -62.41 -70.02 0.22 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 119.096 -1.041 . . . . 2.3599999999999999 109.807 174.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -56.12 -23.82 36.72 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 116.587 2.069 . . . . 2.1899999999999999 116.587 -176.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.3 p -121.61 25.14 9.47 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 114.247 1.203 . . . . 1.26 114.247 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 596' ' ' ARG . . . . . 0.423 ' HE ' ' HA ' ' B' ' 596' ' ' ARG . 0.0 OUTLIER -48.5 -38.6 20.57 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.824 1.787 . . . . 3.5800000000000001 115.824 -172.404 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . 0.424 ' O ' HG12 ' B' ' 600' ' ' VAL . 24.1 tpp180 -69.48 -32.62 71.62 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.214 0.82 . . . . 3.7400000000000002 113.214 -175.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 598' ' ' HIS . . . . . 0.597 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 57.5 m-70 -70.15 -3.9 18.93 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.619 -0.719 . . . . 2.1400000000000001 112.05 -173.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 599' ' ' PHE . . . . . 0.532 ' HE1' HD21 ' B' ' 562' ' ' LEU . 6.1 m-85 -105.51 -16.96 14.57 Favored 'General case' 0 CA--C 1.516 -0.329 0 O-C-N 123.669 0.606 . . . . 2.9500000000000002 110.268 -176.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 600' ' ' VAL . . . . . 0.424 HG12 ' O ' ' B' ' 597' ' ' ARG . 9.3 p -105.84 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.039 -0.982 . . . . 1.4199999999999999 111.325 -175.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -101.95 139.53 37.46 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.547 -0.861 . . . . 2.3399999999999999 111.601 176.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 5.7 p -60.91 122.76 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.489 0 N-CA-C 108.577 -0.898 . . . . 1.3700000000000001 108.577 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -92.83 167.34 11.91 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 123.705 0.628 . . . . 2.6800000000000002 110.051 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 17.3 m -71.93 128.96 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 N-CA-C 112.981 0.734 . . . . 1.27 112.981 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.38 6.51 64.4 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.082 -175.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -131.55 158.04 42.0 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.555 -0.858 . . . . 2.5099999999999998 110.766 175.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 31.5 m -103.24 -22.56 4.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.093 -0.958 . . . . 1.3999999999999999 112.507 -175.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 608' ' ' MET . . . . . 0.46 ' HG3' ' HD2' ' B' ' 609' ' ' PRO . 59.6 ttp -136.99 142.26 37.79 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.643 0.609 . . . . 2.6800000000000002 112.643 -174.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 609' ' ' PRO . . . . . 0.46 ' HD2' ' HG3' ' B' ' 608' ' ' MET . 68.9 Cg_exo -52.09 130.92 37.03 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.928 1.085 . . . . 0.42999999999999999 112.094 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -57.01 -31.86 65.54 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.792 0.293 . . . . 2.3700000000000001 111.792 -174.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 611' ' ' ILE . . . . . 0.419 HG23 ' N ' ' B' ' 612' ' ' ASP . 14.0 tt -50.06 -44.75 22.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.814 0.34 . . . . 1.8400000000000001 110.592 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 612' ' ' ASP . . . . . 0.419 ' N ' HG23 ' B' ' 611' ' ' ILE . 20.8 m-20 -49.92 -52.11 35.7 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.632 0.773 . . . . 2.1499999999999999 112.854 177.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -59.84 -37.14 78.39 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.612 -0.435 . . . . 2.6600000000000001 110.21 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 41.6 mm -64.49 -48.04 86.71 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 120.169 -0.612 . . . . 1.76 111.946 178.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.57 -31.13 71.88 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.012 0.745 . . . . 1.8400000000000001 113.012 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -79.55 2.1 23.46 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.569 1.322 . . . . 2.0600000000000001 114.569 -179.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 36.5 p30 -142.42 15.59 2.02 Favored 'General case' 0 C--O 1.242 0.685 0 N-CA-C 113.143 0.794 . . . . 1.97 113.143 -174.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 618' ' ' ILE . . . . . 0.453 HG23 ' N ' ' B' ' 619' ' ' ASN . 10.7 tt -46.9 -46.99 8.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.0099999999999998 110.222 -176.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 619' ' ' ASN . . . . . 0.453 ' N ' HG23 ' B' ' 618' ' ' ILE . 45.4 t-20 -63.23 -51.06 67.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.754 1.02 . . . . 2.2799999999999998 113.754 -176.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 73.3 p -56.89 -31.88 65.31 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 119.455 -0.898 . . . . 1.3200000000000001 110.782 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 621' ' ' ILE . . . . . 0.456 HG23 ' HD1' ' B' ' 570' ' ' PHE . 17.7 mt -79.33 -42.64 23.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.334 1.605 . . . . 2.0 115.334 -179.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 622' ' ' ILE . . . . . 0.67 ' HA ' HD23 ' B' ' 625' ' ' LEU . 14.3 mt -87.69 -6.22 10.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.055 1.502 . . . . 2.0899999999999999 115.055 -177.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 44.1 t -20.0 -58.34 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 116.529 2.048 . . . . 1.47 116.529 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -99.21 -7.58 26.3 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.977 -1.465 . . . . 2.0699999999999998 111.027 -163.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 625' ' ' LEU . . . . . 0.842 HD21 ' HB3' ' B' ' 573' ' ' MET . 3.6 mm? -71.97 146.86 47.47 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.443 -0.344 . . . . 1.6699999999999999 111.689 -173.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 626' ' ' GLN . . . . . 0.642 ' O ' HG23 ' B' ' 630' ' ' VAL . 47.5 mt-30 -76.68 162.0 72.13 Favored Pre-proline 0 CA--C 1.519 -0.241 0 N-CA-C 108.834 -0.802 . . . . 2.3500000000000001 108.834 174.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 627' ' ' PRO . . . . . 0.558 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 5.4 Cg_endo -47.71 -43.67 28.12 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 N-CA-C 115.825 1.433 . . . . 0.44 115.825 -178.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -67.31 -43.07 82.56 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.563 -0.532 . . . . 2.6200000000000001 109.563 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -63.26 -38.29 90.57 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.946 -0.57 . . . . 2.0600000000000001 110.926 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 630' ' ' VAL . . . . . 0.642 HG23 ' O ' ' B' ' 626' ' ' GLN . 38.6 t . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.316 -0.85 . . . . 1.3 110.695 176.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 504' ' ' ILE . . . . . 0.861 HG12 ' HB3' ' B' ' 507' ' ' ALA . 14.5 tt . . . . . 0 C--O 1.236 0.371 0 N-CA-C 113.098 0.777 . . . . 2.1299999999999999 113.098 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 48.1 m -48.85 119.2 3.01 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.6 0.592 . . . . 1.29 112.6 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.85 1.45 67.75 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.946 -0.645 . . . . 0.0 114.408 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 507' ' ' ALA . . . . . 0.861 ' HB3' HG12 ' B' ' 504' ' ' ILE . . . -94.34 -7.59 41.31 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.646 0.723 . . . . 0.02 112.443 176.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 25.8 mmt -112.4 160.06 18.1 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 121.116 0.484 . . . . 2.21 112.283 174.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -69.76 134.26 48.38 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.085 -0.709 . . . . 2.6699999999999999 109.085 174.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 510' ' ' GLU . . . . . 0.606 ' HB2' HH21 ' B' ' 553' ' ' ARG . 39.7 tt0 -41.68 -35.47 0.78 Allowed 'General case' 0 C--O 1.24 0.598 0 N-CA-C 113.394 0.887 . . . . 2.6600000000000001 113.394 -173.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -73.73 -41.94 61.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.515 -0.766 . . . . 2.4399999999999999 112.117 -176.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -64.79 -40.16 94.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.178 0.513 . . . . 2.0800000000000001 110.878 171.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 513' ' ' GLU . . . . . 0.476 ' O ' HD13 ' B' ' 517' ' ' LEU . 45.0 tt0 -53.76 -48.62 69.56 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.344 -0.843 . . . . 1.9199999999999999 111.091 177.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 514' ' ' LYS . . . . . 0.416 ' O ' HG13 ' B' ' 518' ' ' VAL . 24.8 ttpp -54.9 -57.59 11.02 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 111.911 0.337 . . . . 2.73 111.911 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 515' ' ' ARG . . . . . 0.466 ' O ' HG22 ' B' ' 518' ' ' VAL . 37.1 ttm180 -56.6 -35.89 68.77 Favored 'General case' 0 CA--C 1.506 -0.733 0 O-C-N 124.209 0.943 . . . . 3.75 111.127 -177.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.498 ' O ' HG23 ' B' ' 520' ' ' VAL . 73.8 t80 -76.11 -45.58 33.11 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.065 -0.971 . . . . 1.8899999999999999 110.515 -173.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 517' ' ' LEU . . . . . 0.638 HD21 ' CG ' ' B' ' 551' ' ' TYR . 8.7 mp -66.73 -32.25 73.42 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.755 -0.657 . . . . 1.8999999999999999 112.642 177.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 518' ' ' VAL . . . . . 0.466 HG22 ' O ' ' B' ' 515' ' ' ARG . 28.3 m -67.49 -35.1 72.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 118.535 -1.266 . . . . 1.3999999999999999 109.07 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 20.7 p -72.99 -36.31 67.03 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.393 0.616 . . . . 1.1799999999999999 112.408 178.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 520' ' ' VAL . . . . . 0.498 HG23 ' O ' ' B' ' 516' ' ' PHE . 54.5 t -71.23 -42.29 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 122.133 -0.354 . . . . 1.22 111.703 -174.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 521' ' ' ILE . . . . . 0.515 ' O ' HD13 ' B' ' 525' ' ' LEU . 2.3 pp -90.68 -25.83 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.442 1.645 . . . . 1.98 115.442 -175.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 6.1 tmmm? -60.75 -35.24 75.89 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.712 -0.847 . . . . 2.5699999999999998 108.712 173.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -92.42 -21.53 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.979 1.474 . . . . 2.1699999999999999 114.979 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 38.4 mt -70.58 -45.43 65.37 Favored 'General case' 0 C--O 1.218 -0.588 0 N-CA-C 109.313 -0.625 . . . . 1.48 109.313 168.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . 0.635 HD12 HD13 ' B' ' 544' ' ' ILE . 7.5 mp -52.19 -45.43 65.15 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.197 0.522 . . . . 1.95 110.978 169.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 526' ' ' GLY . . . . . 0.455 ' O ' ' HG2' ' B' ' 529' ' ' GLU . . . -66.51 -40.63 94.33 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 -178.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 47.0 mt -63.52 -36.07 82.57 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 1.6699999999999999 111.47 175.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 528' ' ' CYS . . . . . 0.518 ' HB2' HG21 ' B' ' 540' ' ' ILE . 49.5 t -63.54 -47.7 80.55 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.08 -0.509 . . . . 0.58999999999999997 110.662 -175.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 529' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' B' ' 526' ' ' GLY . 13.0 pt-20 -61.8 -29.58 70.25 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.44 -0.8 . . . . 2.5 112.542 173.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -71.68 -54.64 9.67 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.376 0.88 . . . . 2.2400000000000002 113.376 -177.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 531' ' ' LYS . . . . . 0.46 ' O ' ' HD2' ' B' ' 537' ' ' LYS . 67.6 mttm -68.8 137.95 54.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.964 -0.562 . . . . 2.2799999999999998 111.119 -177.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -96.46 160.7 14.27 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.811 -0.631 . . . . 4.21 110.231 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.5 119.57 1.36 Allowed Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 115.905 -0.589 . . . . 0.0 114.019 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 534' ' ' LYS . . . . . 0.462 ' HD3' ' N ' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.11 -36.65 8.61 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.176 0.806 . . . . 2.9500000000000002 113.176 177.274 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -50.51 -51.92 43.22 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.382 -0.527 . . . . 2.2000000000000002 110.828 174.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 536' ' ' ASN . . . . . 0.479 ' O ' HD13 ' B' ' 540' ' ' ILE . 14.0 m120 -65.98 -44.85 83.66 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.697 0.628 . . . . 1.47 112.697 178.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 537' ' ' LYS . . . . . 0.46 ' HD2' ' O ' ' B' ' 531' ' ' LYS . 0.0 OUTLIER -67.78 -31.97 72.23 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.375 -0.53 . . . . 2.5 110.368 -174.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.2 -46.95 69.21 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.79 -0.641 . . . . 0.040000000000000001 111.079 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 85.9 mt -58.1 -54.98 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.558 0.694 . . . . 1.8200000000000001 111.295 173.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 540' ' ' ILE . . . . . 0.518 HG21 ' HB2' ' B' ' 528' ' ' CYS . 1.7 mp -56.82 -48.04 81.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.719 -0.613 . . . . 1.8500000000000001 110.632 -178.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 541' ' ' ALA . . . . . 0.5 ' O ' ' HG2' ' B' ' 545' ' ' MET . . . -57.44 -44.21 84.55 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 113.514 0.931 . . . . 0.02 113.514 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 90.7 p -60.36 -38.78 84.94 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.601 -0.44 . . . . 1.2 110.271 -178.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 543' ' ' ASN . . . . . 0.442 ' O ' HG12 ' B' ' 547' ' ' ILE . 3.1 t-20 -69.06 -47.06 66.28 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 114.362 1.245 . . . . 2.0299999999999998 114.362 -175.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 544' ' ' ILE . . . . . 0.635 HD13 HD12 ' B' ' 525' ' ' LEU . 23.1 mt -52.66 -45.89 48.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.539 -0.912 . . . . 1.8100000000000001 108.539 170.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 545' ' ' MET . . . . . 0.779 ' HB3' HG21 ' B' ' 587' ' ' THR . 33.4 mmt -64.05 -42.33 97.07 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 119.659 -0.816 . . . . 2.6000000000000001 112.833 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -58.28 -48.77 79.41 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 119.189 -1.004 . . . . 2.0800000000000001 109.893 176.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 547' ' ' ILE . . . . . 0.442 HG12 ' O ' ' B' ' 543' ' ' ASN . 43.3 mm -55.06 -61.48 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.77 0.656 . . . . 1.5 112.77 179.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 548' ' ' VAL . . . . . 0.718 HG13 HD11 ' B' ' 555' ' ' LEU . 97.9 t -47.3 -44.27 8.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 119.817 -0.753 . . . . 1.3999999999999999 111.427 176.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.02 58.81 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.791 -0.568 . . . . 0.0 112.934 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -87.05 -9.55 55.21 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.629 0.604 . . . . 2.27 112.629 -175.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 551' ' ' TYR . . . . . 0.638 ' CG ' HD21 ' B' ' 517' ' ' LEU . 84.7 m-85 -120.45 59.69 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.798 1.036 . . . . 3.5299999999999998 113.798 -176.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -55.97 -39.36 91.65 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 O-C-N 122.183 0.57 . . . . 0.46000000000000002 113.162 177.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 553' ' ' ARG . . . . . 0.606 HH21 ' HB2' ' B' ' 510' ' ' GLU . 11.2 ptm180 -56.33 -46.72 79.77 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 121.147 0.499 . . . . 3.8700000000000001 109.935 -174.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -48.96 -59.72 3.37 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.927 0.891 . . . . 0.69999999999999996 112.12 167.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 555' ' ' LEU . . . . . 0.718 HD11 HG13 ' B' ' 548' ' ' VAL . 11.1 mp -54.39 -48.49 71.49 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 116.305 -0.407 . . . . 1.49 110.177 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -53.94 -35.88 62.19 Favored 'General case' 0 C--O 1.242 0.682 0 N-CA-C 113.791 1.034 . . . . 3.0899999999999999 113.791 -178.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.1 -12.16 50.78 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.458 -0.497 . . . . 0.0 112.047 -177.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 17.4 t-160 -128.26 78.51 1.84 Allowed 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.456 1.28 . . . . 2.9300000000000002 114.456 -177.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -50.48 -48.26 56.76 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 116.584 2.068 . . . . 3.1099999999999999 116.584 -176.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 560' ' ' LYS . . . . . 0.426 ' O ' HG23 ' B' ' 564' ' ' THR . 4.7 tppp? -56.71 -36.65 69.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.325 -0.398 . . . . 3.3199999999999998 111.099 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 561' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -74.84 -45.14 45.21 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.095 -1.042 . . . . 1.25 111.916 175.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . 0.557 ' O ' HG12 ' B' ' 565' ' ' VAL . 6.3 tt -49.99 -59.15 4.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.529 0.332 . . . . 1.3200000000000001 110.226 175.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -50.21 -38.54 40.71 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.912 1.079 . . . . 2.7400000000000002 113.912 178.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 564' ' ' THR . . . . . 0.426 HG23 ' O ' ' B' ' 560' ' ' LYS . 24.0 p -71.92 -39.31 69.56 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.498 0.666 . . . . 1.24 110.371 -176.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 565' ' ' VAL . . . . . 0.689 HG21 HG11 ' B' ' 548' ' ' VAL . 0.3 OUTLIER -62.83 -41.24 91.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.676 -0.693 . . . . 1.1899999999999999 112.543 173.361 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 566' ' ' VAL . . . . . . . . . . . . . 85.2 t -71.11 -50.83 39.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 C-N-CA 120.519 -0.473 . . . . 1.3600000000000001 110.845 -176.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 15.1 m-80 -51.09 -37.42 45.63 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.965 -0.562 . . . . 1.9399999999999999 112.01 170.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 36.1 mmtm -72.58 -32.76 66.26 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.701 -0.481 . . . . 3.5299999999999998 109.701 -179.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 569' ' ' LEU . . . . . 0.432 HD13 ' O ' ' B' ' 565' ' ' VAL . 4.3 mp -67.45 -36.51 81.34 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 108.737 -0.838 . . . . 2.0099999999999998 108.737 177.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 570' ' ' PHE . . . . . 0.602 ' HA ' HD11 ' B' ' 621' ' ' ILE . 18.2 m-30 -65.29 -39.35 92.41 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.915 -0.402 . . . . 3.77 109.915 178.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.448 ' O ' ' ND1' ' B' ' 574' ' ' HIS . 36.8 tt0 -57.74 -53.44 58.16 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 119.921 -0.711 . . . . 2.4700000000000002 110.508 176.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -62.43 -10.0 10.15 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.11 1.152 . . . . 1.23 114.11 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 573' ' ' MET . . . . . 0.5 ' HB3' HD21 ' B' ' 625' ' ' LEU . 54.9 mtt -76.4 -5.31 46.73 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.703 0.763 . . . . 2.1099999999999999 109.646 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 574' ' ' HIS . . . . . 0.448 ' ND1' ' O ' ' B' ' 571' ' ' GLU . 0.0 OUTLIER -109.48 -0.51 18.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.729 -1.123 . . . . 3.2000000000000002 111.434 173.792 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 575' ' ' GLU . . . . . 0.411 ' HG2' HG11 ' B' ' 580' ' ' VAL . 9.7 tp10 -68.51 130.18 42.11 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 116.217 -0.447 . . . . 1.55 110.094 177.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 3.9 t -87.79 -21.31 25.18 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.984 0.735 . . . . 1.3999999999999999 112.984 -177.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 30.2 m80 -60.11 128.03 34.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.385 0.612 . . . . 2.8500000000000001 112.597 -175.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -44.92 125.84 5.39 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.372 -0.831 . . . . 2.1499999999999999 113.132 -171.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.3 -34.74 4.77 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.203 1.241 . . . . 0.0 116.203 174.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 580' ' ' VAL . . . . . 0.411 HG11 ' HG2' ' B' ' 575' ' ' GLU . 47.5 t -53.67 -46.36 61.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.195 0.813 . . . . 1.29 113.195 -175.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 22.2 pt20 -59.72 -42.22 92.6 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.406 0.521 . . . . 1.99 112.406 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.54 -42.43 96.52 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.155 0.428 . . . . 2.23 112.155 172.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 90.8 mmm -60.72 -49.46 77.41 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.069 -0.252 . . . . 2.5800000000000001 110.43 175.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.78 -43.0 80.41 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.154 -0.475 . . . . 0.029999999999999999 111.664 -177.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 585' ' ' CYS . . . . . 0.434 ' O ' HG12 ' B' ' 589' ' ' ILE . 52.7 t -74.38 -40.99 61.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 120.042 -0.663 . . . . 1.5 111.912 -177.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -59.58 -46.34 89.21 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.316 -0.402 . . . . 1.98 111.95 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 587' ' ' THR . . . . . 0.779 HG21 ' HB3' ' B' ' 545' ' ' MET . 36.4 p -62.15 -41.26 98.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.3 110.366 175.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -61.41 -32.25 72.19 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.147 -0.478 . . . . 0.53000000000000003 111.129 -177.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 589' ' ' ILE . . . . . 0.434 HG12 ' O ' ' B' ' 585' ' ' CYS . 50.3 mm -79.88 -36.02 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 C-N-CA 116.902 -1.919 . . . . 1.97 109.775 -175.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . 0.403 ' NZ ' ' HA ' ' B' ' 587' ' ' THR . 36.8 mtmm -57.4 -50.01 74.35 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 107.75 -1.204 . . . . 2.6200000000000001 107.75 176.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 83.9 mt -63.84 -43.76 97.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.697 -0.683 . . . . 1.96 112.726 -176.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.96 -39.1 93.37 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.425 -0.51 . . . . 0.0 112.285 177.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -62.38 -70.04 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 119.096 -1.041 . . . . 2.3599999999999999 109.815 174.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -56.16 -23.72 36.66 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 116.596 2.073 . . . . 2.1899999999999999 116.596 -176.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 82.8 m -121.71 25.14 9.42 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 114.241 1.2 . . . . 1.26 114.241 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -48.52 -38.47 20.4 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.835 1.791 . . . . 3.5800000000000001 115.835 -172.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -69.7 -32.54 71.19 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.212 0.819 . . . . 3.7400000000000002 113.212 -175.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 55.3 m80 -70.16 -3.77 18.36 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.593 -0.731 . . . . 2.1400000000000001 112.08 -173.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -105.53 -17.01 14.55 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.564 0.54 . . . . 2.9500000000000002 110.241 -176.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 21.6 t -105.82 -24.37 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.025 -0.989 . . . . 1.4199999999999999 111.327 -175.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -101.97 139.49 37.53 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 119.566 -0.854 . . . . 2.3399999999999999 111.576 176.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 11.8 m -60.85 122.69 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.671 -0.863 . . . . 1.3700000000000001 108.671 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -92.75 167.3 11.97 Favored 'General case' 0 C--O 1.225 -0.213 0 O-C-N 123.659 0.599 . . . . 2.6800000000000002 110.111 -177.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 34.9 t -71.94 128.96 35.47 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 N-CA-C 112.949 0.722 . . . . 1.27 112.949 -175.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.33 6.59 64.42 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.11 -175.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -131.53 157.99 42.12 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.565 -0.854 . . . . 2.5099999999999998 110.745 175.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 29.2 t -103.2 -22.62 4.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.029 -0.987 . . . . 1.3999999999999999 112.496 -175.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 608' ' ' MET . . . . . . . . . . . . . 66.0 mtm -136.91 142.25 37.87 Favored Pre-proline 0 C--O 1.223 -0.302 0 N-CA-C 112.626 0.602 . . . . 2.6800000000000002 112.626 -174.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 609' ' ' PRO . . . . . 0.543 ' HB2' HG22 ' B' ' 611' ' ' ILE . 9.6 Cg_endo -52.08 130.88 36.85 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.845 1.03 . . . . 0.42999999999999999 112.131 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -57.02 -31.79 65.49 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.826 0.306 . . . . 2.3700000000000001 111.826 -174.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 611' ' ' ILE . . . . . 0.543 HG22 ' HB2' ' B' ' 609' ' ' PRO . 5.9 tp -50.1 -44.74 22.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 120.782 0.325 . . . . 1.8400000000000001 110.577 178.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 612' ' ' ASP . . . . . 0.411 ' N ' HG23 ' B' ' 611' ' ' ILE . 16.7 t70 -49.9 -52.12 35.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.632 0.773 . . . . 2.1499999999999999 112.855 177.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 613' ' ' GLU . . . . . 0.553 ' HA ' ' ND2' ' B' ' 616' ' ' ASN . 45.7 mt-10 -59.86 -37.03 78.16 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 120.512 -0.475 . . . . 2.6600000000000001 110.231 179.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 62.1 mt -64.58 -48.03 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 120.149 -0.62 . . . . 1.76 111.907 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.63 -31.13 71.93 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.959 0.725 . . . . 1.8400000000000001 112.959 -177.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 616' ' ' ASN . . . . . 0.553 ' ND2' ' HA ' ' B' ' 613' ' ' GLU . 20.6 p30 -79.57 2.15 23.33 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.559 1.318 . . . . 2.0600000000000001 114.559 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -142.43 15.67 2.02 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 113.114 0.783 . . . . 1.97 113.114 -174.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 618' ' ' ILE . . . . . 0.542 ' O ' HG22 ' B' ' 621' ' ' ILE . 5.0 tp -46.95 -47.01 8.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 C-N-CA 118.973 -1.091 . . . . 2.0099999999999998 110.135 -176.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 619' ' ' ASN . . . . . 0.426 ' N ' HG23 ' B' ' 618' ' ' ILE . 41.5 t-20 -63.23 -51.07 67.72 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 113.749 1.018 . . . . 2.2799999999999998 113.749 -176.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 72.6 p -56.9 -31.93 65.39 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.455 -0.898 . . . . 1.3200000000000001 110.737 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 621' ' ' ILE . . . . . 0.602 HD11 ' HA ' ' B' ' 570' ' ' PHE . 0.4 OUTLIER -79.32 -42.54 23.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 115.362 1.615 . . . . 2.0 115.362 -178.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 622' ' ' ILE . . . . . 0.409 HG12 ' O ' ' B' ' 618' ' ' ILE . 37.6 pt -87.73 -6.27 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.037 1.495 . . . . 2.0899999999999999 115.037 -177.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 54.0 t -19.9 -58.33 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 116.642 2.09 . . . . 1.47 116.642 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -99.29 -7.56 26.18 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.028 -1.442 . . . . 2.0699999999999998 110.989 -163.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 625' ' ' LEU . . . . . 0.5 HD21 ' HB3' ' B' ' 573' ' ' MET . 93.7 mt -71.94 146.93 47.46 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.295 0.372 . . . . 1.6699999999999999 111.694 -173.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 626' ' ' GLN . . . . . 0.714 ' O ' HG13 ' B' ' 630' ' ' VAL . 17.3 mp0 -76.74 162.1 71.65 Favored Pre-proline 0 N--CA 1.463 0.189 0 N-CA-C 108.776 -0.824 . . . . 2.3500000000000001 108.776 174.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 627' ' ' PRO . . . . . 0.757 ' O ' HG22 ' B' ' 630' ' ' VAL . 79.4 Cg_exo -47.81 -43.56 28.89 Favored 'Trans proline' 0 CA--C 1.529 0.243 0 N-CA-C 115.856 1.445 . . . . 0.44 115.856 -178.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -67.36 -43.02 82.47 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.608 -0.516 . . . . 2.6200000000000001 109.608 -174.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -63.28 -38.33 90.72 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.929 -0.578 . . . . 2.0600000000000001 110.831 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 630' ' ' VAL . . . . . 0.757 HG22 ' O ' ' B' ' 627' ' ' PRO . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.353 -0.832 . . . . 1.3 110.661 176.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 504' ' ' ILE . . . . . 0.937 HG13 ' HB3' ' B' ' 507' ' ' ALA . 7.6 tp . . . . . 0 C--O 1.235 0.309 0 N-CA-C 113.076 0.769 . . . . 2.1299999999999999 113.076 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 80.0 p -48.91 119.12 2.97 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.53 0.567 . . . . 1.29 112.53 174.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.9 1.39 67.67 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 120.964 -0.636 . . . . 0.0 114.37 -179.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 507' ' ' ALA . . . . . 0.937 ' HB3' HG13 ' B' ' 504' ' ' ILE . . . -94.29 -7.56 41.57 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 117.736 0.768 . . . . 0.02 112.405 176.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -112.49 160.02 18.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.191 0.519 . . . . 2.21 112.186 174.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -69.78 134.14 48.23 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.131 -0.692 . . . . 2.6699999999999999 109.131 174.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -41.57 -35.46 0.73 Allowed 'General case' 0 C--O 1.24 0.567 0 N-CA-C 113.421 0.897 . . . . 2.6600000000000001 113.421 -173.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.78 -41.96 61.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.505 -0.771 . . . . 2.4399999999999999 112.082 -176.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.87 -40.04 94.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.133 0.492 . . . . 2.0800000000000001 110.893 171.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -53.66 -48.76 69.12 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.387 -0.824 . . . . 1.9199999999999999 111.102 177.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 514' ' ' LYS . . . . . 0.46 ' O ' HG23 ' B' ' 518' ' ' VAL . 7.3 mtpm? -54.77 -57.67 10.62 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 111.869 0.322 . . . . 2.73 111.869 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 515' ' ' ARG . . . . . 0.403 ' O ' HG23 ' B' ' 519' ' ' THR . 61.3 ttp180 -56.59 -35.96 68.82 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.173 0.921 . . . . 3.75 111.086 -177.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.571 ' O ' HG23 ' B' ' 520' ' ' VAL . 62.5 t80 -76.09 -45.6 33.16 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.159 -0.928 . . . . 1.8899999999999999 110.514 -173.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 517' ' ' LEU . . . . . 0.417 ' O ' HG22 ' B' ' 521' ' ' ILE . 13.7 tp -66.74 -32.25 73.43 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.731 -0.668 . . . . 1.8999999999999999 112.615 177.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 518' ' ' VAL . . . . . 0.515 ' O ' ' HB2' ' B' ' 522' ' ' LYS . 69.3 t -67.5 -35.13 72.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 118.58 -1.248 . . . . 1.3999999999999999 109.081 178.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 519' ' ' THR . . . . . 0.403 HG23 ' O ' ' B' ' 515' ' ' ARG . 74.1 p -72.94 -36.37 67.19 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.1799999999999999 112.413 178.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 520' ' ' VAL . . . . . 0.571 HG23 ' O ' ' B' ' 516' ' ' PHE . 67.0 t -71.14 -42.45 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 116.46 -0.336 . . . . 1.22 111.638 -174.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 521' ' ' ILE . . . . . 0.417 HG22 ' O ' ' B' ' 517' ' ' LEU . 17.6 tt -90.65 -25.78 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 115.406 1.632 . . . . 1.98 115.406 -175.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 522' ' ' LYS . . . . . 0.515 ' HB2' ' O ' ' B' ' 518' ' ' VAL . 0.3 OUTLIER -60.92 -35.25 76.2 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.599 -0.889 . . . . 2.5699999999999998 108.599 173.6 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -92.4 -21.35 20.27 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.062 1.504 . . . . 2.1699999999999999 115.062 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 68.5 mt -70.64 -45.38 65.26 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.3 -0.63 . . . . 1.48 109.3 168.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.31 -45.4 65.56 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.2 0.524 . . . . 1.95 110.931 169.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.55 -40.47 94.22 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 40.2 mt -63.63 -36.14 82.84 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.043 0.449 . . . . 1.6699999999999999 111.426 175.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 48.1 t -63.47 -47.74 80.54 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.041 -0.527 . . . . 0.58999999999999997 110.648 -175.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -61.8 -29.52 70.21 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.472 -0.786 . . . . 2.5 112.517 173.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -71.71 -54.65 9.61 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.353 0.872 . . . . 2.2400000000000002 113.353 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -68.76 137.94 54.44 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.008 -0.542 . . . . 2.2799999999999998 111.07 -177.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 532' ' ' ARG . . . . . 0.438 ' HA ' ' NZ ' ' B' ' 537' ' ' LYS . 35.8 mmt180 -96.44 160.67 14.28 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.774 -0.648 . . . . 4.21 110.183 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.44 119.67 1.36 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.984 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 534' ' ' LYS . . . . . 0.691 ' H ' ' HD2' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.18 -36.64 8.92 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.207 0.817 . . . . 2.9500000000000002 113.207 177.245 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -50.5 -51.85 43.66 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.413 -0.515 . . . . 2.2000000000000002 110.828 174.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -66.09 -44.85 83.21 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.62 0.6 . . . . 1.47 112.62 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 537' ' ' LYS . . . . . 0.438 ' NZ ' ' HA ' ' B' ' 532' ' ' ARG . 64.6 mttp -67.87 -31.98 72.16 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.272 -174.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.09 -46.99 69.45 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.839 -0.619 . . . . 0.040000000000000001 111.115 178.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 75.8 mt -58.12 -55.03 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 121.569 0.699 . . . . 1.8200000000000001 111.194 173.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 540' ' ' ILE . . . . . . . . . . . . . 94.0 mt -56.81 -48.07 81.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.605 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 541' ' ' ALA . . . . . 0.451 ' O ' HG12 ' B' ' 544' ' ' ILE . . . -57.49 -43.99 84.6 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 113.583 0.957 . . . . 0.02 113.583 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 94.8 p -60.46 -38.86 85.54 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.647 -0.421 . . . . 1.2 110.215 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 543' ' ' ASN . . . . . 0.469 ' O ' HG12 ' B' ' 547' ' ' ILE . 49.5 t30 -69.05 -47.05 66.35 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 114.352 1.241 . . . . 2.0299999999999998 114.352 -175.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 544' ' ' ILE . . . . . 0.476 HG13 ' N ' ' B' ' 545' ' ' MET . 48.9 pt -52.63 -45.94 48.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.492 -0.929 . . . . 1.8100000000000001 108.492 170.032 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 545' ' ' MET . . . . . 0.476 ' N ' HG13 ' B' ' 544' ' ' ILE . 21.4 mmt -64.03 -42.33 97.12 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.729 -0.788 . . . . 2.6000000000000001 112.818 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -58.3 -48.78 79.41 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 119.181 -1.007 . . . . 2.0800000000000001 109.887 176.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 547' ' ' ILE . . . . . 0.469 HG12 ' O ' ' B' ' 543' ' ' ASN . 42.0 mm -55.06 -61.38 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.823 0.675 . . . . 1.5 112.823 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 548' ' ' VAL . . . . . 0.445 HG22 ' HA ' ' B' ' 545' ' ' MET . 36.0 m -47.44 -44.23 9.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 C-N-CA 119.854 -0.738 . . . . 1.3999999999999999 111.388 176.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.03 58.82 Favored Glycine 0 C--O 1.237 0.336 0 O-C-N 121.791 -0.568 . . . . 0.0 112.917 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 550' ' ' GLN . . . . . 0.569 HE21 ' HA ' ' B' ' 550' ' ' GLN . 0.1 OUTLIER -87.04 -9.58 55.14 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 112.629 0.604 . . . . 2.27 112.629 -175.356 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 551' ' ' TYR . . . . . 0.427 ' O ' HD13 ' B' ' 555' ' ' LEU . 64.4 m-85 -120.38 59.63 6.95 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 113.857 1.058 . . . . 3.5299999999999998 113.857 -176.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 552' ' ' PRO . . . . . 0.568 ' HG3' ' HG2' ' B' ' 594' ' ' LYS . 15.4 Cg_endo -55.99 -39.35 91.72 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.122 0.538 . . . . 0.46000000000000002 113.115 178.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 22.0 tpp180 -56.3 -46.81 79.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.134 0.492 . . . . 3.8700000000000001 109.859 -174.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 554' ' ' PHE . . . . . 0.484 ' HD2' HD12 ' B' ' 555' ' ' LEU . 67.8 t80 -48.88 -59.81 3.27 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.935 0.894 . . . . 0.69999999999999996 112.098 168.014 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 555' ' ' LEU . . . . . 0.484 HD12 ' HD2' ' B' ' 554' ' ' PHE . 8.2 mp -54.26 -48.62 70.96 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.303 -0.408 . . . . 1.49 110.219 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -53.83 -35.91 61.96 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.831 1.049 . . . . 3.0899999999999999 113.831 -178.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.03 -12.25 50.76 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.517 -0.473 . . . . 0.0 112.088 -177.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -128.18 78.5 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 2.9300000000000002 114.388 -177.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 22.0 m-90 -50.52 -48.32 57.18 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 116.534 2.05 . . . . 3.1099999999999999 116.534 -176.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 560' ' ' LYS . . . . . 0.514 ' HA ' ' HE3' ' B' ' 563' ' ' LYS . 37.8 mtmm -56.48 -36.66 69.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.324 -0.398 . . . . 3.3199999999999998 111.213 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 561' ' ' PHE . . . . . 0.436 ' O ' HG23 ' B' ' 565' ' ' VAL . 0.7 OUTLIER -74.95 -45.07 44.81 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 119.142 -1.023 . . . . 1.25 111.871 175.613 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . 0.512 ' O ' HG23 ' B' ' 566' ' ' VAL . 3.9 tp -50.01 -59.15 4.17 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.509 0.324 . . . . 1.3200000000000001 110.258 175.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 563' ' ' LYS . . . . . 0.514 ' HE3' ' HA ' ' B' ' 560' ' ' LYS . 19.6 pttp -50.18 -38.66 40.81 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.896 1.073 . . . . 2.7400000000000002 113.896 178.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 62.4 m -71.74 -39.39 70.1 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.562 0.696 . . . . 1.24 110.413 -176.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 565' ' ' VAL . . . . . 0.436 HG23 ' O ' ' B' ' 561' ' ' PHE . 92.2 t -62.84 -41.34 92.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.646 -0.706 . . . . 1.1899999999999999 112.527 173.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 566' ' ' VAL . . . . . 0.512 HG23 ' O ' ' B' ' 562' ' ' LEU . 36.2 t -70.93 -50.85 40.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 120.551 -0.46 . . . . 1.3600000000000001 110.924 -176.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -51.11 -37.38 45.67 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.03 -0.532 . . . . 1.9399999999999999 111.987 170.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 568' ' ' LYS . . . . . 0.477 ' HZ3' ' HB2' ' B' ' 568' ' ' LYS . 0.6 OUTLIER -72.72 -32.68 65.89 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.599 -0.519 . . . . 3.5299999999999998 109.599 -179.117 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 569' ' ' LEU . . . . . 0.443 HD23 ' HB2' ' B' ' 588' ' ' PHE . 3.4 mp -67.53 -36.42 80.97 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 108.712 -0.847 . . . . 2.0099999999999998 108.712 177.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -65.34 -39.39 92.33 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.899 -0.408 . . . . 3.77 109.899 178.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -57.67 -53.46 57.94 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 120.036 -0.665 . . . . 2.4700000000000002 110.521 176.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -62.57 -9.91 10.36 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.018 1.118 . . . . 1.23 114.018 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 573' ' ' MET . . . . . 0.417 ' HG3' ' O ' ' B' ' 569' ' ' LEU . 65.6 mtt -76.36 -5.29 46.56 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.671 0.748 . . . . 2.1099999999999999 109.7 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -109.43 -0.54 18.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.73 -1.123 . . . . 3.2000000000000002 111.465 173.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 575' ' ' GLU . . . . . 0.542 ' CG ' HG11 ' B' ' 580' ' ' VAL . 7.2 tp10 -68.59 130.28 42.38 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.189 -0.46 . . . . 1.55 110.104 177.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 62.2 p -87.92 -21.27 25.03 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 113.006 0.743 . . . . 1.3999999999999999 113.006 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 577' ' ' HIS . . . . . 0.773 ' O ' HG12 ' B' ' 580' ' ' VAL . 10.7 t60 -60.2 128.02 34.72 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.418 0.628 . . . . 2.8500000000000001 112.545 -175.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -44.83 125.87 5.32 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.38 -0.827 . . . . 2.1499999999999999 113.135 -171.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.23 -34.74 4.75 Favored Glycine 0 C--O 1.223 -0.57 0 N-CA-C 116.254 1.262 . . . . 0.0 116.254 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 580' ' ' VAL . . . . . 0.773 HG12 ' O ' ' B' ' 577' ' ' HIS . 13.6 p -53.82 -46.34 63.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 113.121 0.785 . . . . 1.29 113.121 -175.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.524 ' N ' HG13 ' B' ' 580' ' ' VAL . 0.7 OUTLIER -59.67 -42.21 92.37 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.406 0.521 . . . . 1.99 112.406 -179.852 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 582' ' ' ASP . . . . . 0.494 ' HA ' ' OE1' ' B' ' 629' ' ' GLN . 19.3 t70 -60.54 -42.5 96.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.149 0.425 . . . . 2.23 112.149 172.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 31.8 mmt -60.66 -49.49 77.29 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 121.109 -0.236 . . . . 2.5800000000000001 110.439 175.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.87 -42.87 80.54 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.176 -0.465 . . . . 0.029999999999999999 111.74 -177.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 44.4 t -74.43 -40.92 61.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 120.009 -0.676 . . . . 1.5 111.957 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.58 -46.31 89.3 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.306 -0.406 . . . . 1.98 111.95 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 41.0 m -62.15 -41.25 98.11 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.329 0.652 . . . . 1.3 110.413 175.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 588' ' ' PHE . . . . . 0.443 ' HB2' HD23 ' B' ' 569' ' ' LEU . 87.0 t80 -61.52 -32.15 72.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.007 -0.542 . . . . 0.53000000000000003 111.125 -177.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 589' ' ' ILE . . . . . . . . . . . . . 47.4 mm -79.86 -36.0 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.871 -1.932 . . . . 1.97 109.8 -175.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -57.44 -50.01 74.39 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 107.713 -1.218 . . . . 2.6200000000000001 107.713 176.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 98.2 mt -63.82 -43.82 98.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 112.786 0.661 . . . . 1.96 112.786 -177.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.83 -39.14 93.52 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 177.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -62.32 -70.14 0.22 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.155 -1.018 . . . . 2.3599999999999999 109.772 174.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 594' ' ' LYS . . . . . 0.568 ' HG2' ' HG3' ' B' ' 552' ' ' PRO . 2.3 mppt? -56.11 -23.84 36.81 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.562 2.06 . . . . 2.1899999999999999 116.562 -176.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 83.6 m -121.67 25.22 9.4 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.263 1.209 . . . . 1.26 114.263 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 596' ' ' ARG . . . . . 0.517 ' HA ' ' CE2' ' B' ' 599' ' ' PHE . 34.4 ptt180 -48.52 -38.54 20.57 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.83 1.789 . . . . 3.5800000000000001 115.83 -172.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 68.7 mtm180 -69.52 -32.61 71.56 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.214 0.82 . . . . 3.7400000000000002 113.214 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -3.81 18.68 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.577 -0.738 . . . . 2.1400000000000001 112.052 -173.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 599' ' ' PHE . . . . . 0.524 ' C ' ' HD1' ' B' ' 599' ' ' PHE . 0.1 OUTLIER -105.62 -16.89 14.57 Favored 'General case' 0 CA--C 1.517 -0.32 0 O-C-N 123.621 0.576 . . . . 2.9500000000000002 110.158 -176.552 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 600' ' ' VAL . . . . . 0.46 ' N ' ' HD1' ' B' ' 599' ' ' PHE . 9.4 p -105.82 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.162 -0.926 . . . . 1.4199999999999999 111.327 -175.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -102.04 139.52 37.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 119.551 -0.86 . . . . 2.3399999999999999 111.596 176.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 3.9 p -60.89 122.74 12.14 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 108.597 -0.89 . . . . 1.3700000000000001 108.597 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -92.76 167.3 11.97 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 123.675 0.609 . . . . 2.6800000000000002 110.086 -177.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 7.4 p -71.94 129.01 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 N-CA-C 112.927 0.714 . . . . 1.27 112.927 -175.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.31 6.53 64.51 Favored Glycine 0 N--CA 1.446 -0.7 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.111 -175.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 606' ' ' GLU . . . . . 0.523 ' HG3' ' H ' ' B' ' 608' ' ' MET . 8.3 tp10 -131.5 158.0 42.04 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.557 -0.857 . . . . 2.5099999999999998 110.746 175.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 16.7 t -103.27 -22.55 4.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.032 -0.985 . . . . 1.3999999999999999 112.451 -175.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 608' ' ' MET . . . . . 0.523 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 88.2 mtp -136.95 142.28 37.94 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.672 0.619 . . . . 2.6800000000000002 112.672 -174.281 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -52.08 130.88 36.86 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.42999999999999999 112.131 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -57.02 -31.76 65.46 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.826 0.306 . . . . 2.3700000000000001 111.826 -174.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 611' ' ' ILE . . . . . 0.518 HG12 ' O ' ' B' ' 599' ' ' PHE . 6.4 pt -50.05 -44.87 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 120.784 0.326 . . . . 1.8400000000000001 110.513 178.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 612' ' ' ASP . . . . . 0.436 ' H ' HG13 ' B' ' 611' ' ' ILE . 24.8 m-20 -49.94 -52.01 36.69 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.621 0.769 . . . . 2.1499999999999999 112.844 177.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -59.94 -37.14 78.65 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.613 -0.435 . . . . 2.6600000000000001 110.175 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 65.2 mt -64.51 -48.02 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.214 -0.594 . . . . 1.76 111.961 178.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 615' ' ' LEU . . . . . 0.597 HD13 HD11 ' B' ' 618' ' ' ILE . 4.5 mm? -62.63 -31.11 71.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.958 0.725 . . . . 1.8400000000000001 112.958 -177.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -79.54 2.14 23.3 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.662 1.356 . . . . 2.0600000000000001 114.662 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -142.42 15.61 2.02 Favored 'General case' 0 C--O 1.243 0.72 0 N-CA-C 113.152 0.797 . . . . 1.97 113.152 -174.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 618' ' ' ILE . . . . . 0.597 HD11 HD13 ' B' ' 615' ' ' LEU . 72.0 mt -46.83 -47.14 8.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 118.997 -1.081 . . . . 2.0099999999999998 110.176 -176.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 619' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -63.09 -51.14 67.79 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.744 1.016 . . . . 2.2799999999999998 113.744 -176.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 32.6 m -56.92 -31.87 65.38 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 119.487 -0.885 . . . . 1.3200000000000001 110.743 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 621' ' ' ILE . . . . . . . . . . . . . 64.6 mt -79.32 -42.7 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 115.334 1.605 . . . . 2.0 115.334 -178.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 622' ' ' ILE . . . . . 0.4 HG12 ' O ' ' B' ' 618' ' ' ILE . 47.2 pt -87.5 -6.48 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 115.059 1.503 . . . . 2.0899999999999999 115.059 -177.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 8.7 p -19.91 -58.3 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.575 2.065 . . . . 1.47 116.575 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -99.26 -7.57 26.23 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 114.045 -1.434 . . . . 2.0699999999999998 111.043 -163.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 625' ' ' LEU . . . . . . . . . . . . . 96.0 mt -71.93 146.9 47.51 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 123.286 0.366 . . . . 1.6699999999999999 111.601 -173.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 626' ' ' GLN . . . . . 0.438 ' O ' HG23 ' B' ' 630' ' ' VAL . 1.7 mp0 -76.74 162.09 71.7 Favored Pre-proline 0 CA--C 1.52 -0.191 0 N-CA-C 108.835 -0.802 . . . . 2.3500000000000001 108.835 174.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -47.85 -43.58 29.09 Favored 'Trans proline' 0 C--O 1.233 0.256 0 N-CA-C 115.765 1.409 . . . . 0.44 115.765 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 628' ' ' GLN . . . . . 0.582 ' HG3' HE21 ' B' ' 629' ' ' GLN . 20.9 pt20 -67.33 -42.98 82.67 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.637 -0.505 . . . . 2.6200000000000001 109.637 -174.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 629' ' ' GLN . . . . . 0.582 HE21 ' HG3' ' B' ' 628' ' ' GLN . 29.1 mm-40 -63.31 -38.23 90.35 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.924 -0.58 . . . . 2.0600000000000001 110.924 178.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 630' ' ' VAL . . . . . 0.438 HG23 ' O ' ' B' ' 626' ' ' GLN . 95.1 t . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.315 -0.85 . . . . 1.3 110.685 176.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 44.7 pt . . . . . 0 C--O 1.237 0.419 0 N-CA-C 113.015 0.746 . . . . 2.1299999999999999 113.015 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 78.4 p -48.83 119.11 2.94 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.519 0.563 . . . . 1.29 112.519 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.76 1.53 67.92 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 120.961 -0.638 . . . . 0.0 114.436 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.39 -7.52 41.35 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 117.685 0.742 . . . . 0.02 112.434 176.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 67.5 mtt -112.45 159.97 18.22 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.116 0.484 . . . . 2.21 112.263 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 72.8 m80 -69.73 134.28 48.45 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.042 -0.725 . . . . 2.6699999999999999 109.042 174.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -41.73 -35.32 0.76 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.409 0.892 . . . . 2.6600000000000001 113.409 -173.255 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -73.88 -41.88 61.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.598 -0.728 . . . . 2.4399999999999999 112.097 -176.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -64.85 -40.18 94.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.184 0.516 . . . . 2.0800000000000001 110.823 171.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -53.61 -48.67 69.07 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.347 -0.842 . . . . 1.9199999999999999 111.199 177.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -54.91 -57.53 11.24 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 111.912 0.338 . . . . 2.73 111.912 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 515' ' ' ARG . . . . . 0.4 ' O ' HG23 ' B' ' 519' ' ' THR . 57.1 ttp180 -56.71 -35.92 69.07 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 124.16 0.913 . . . . 3.75 111.037 -177.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.515 ' O ' HG23 ' B' ' 520' ' ' VAL . 86.1 t80 -76.12 -45.52 33.33 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.191 -0.913 . . . . 1.8899999999999999 110.539 -173.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 517' ' ' LEU . . . . . 0.568 ' O ' HG22 ' B' ' 521' ' ' ILE . 0.2 OUTLIER -66.8 -32.2 73.33 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.738 -0.665 . . . . 1.8999999999999999 112.658 177.104 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 518' ' ' VAL . . . . . . . . . . . . . 3.2 p -67.49 -35.14 72.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 118.483 -1.287 . . . . 1.3999999999999999 109.031 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 519' ' ' THR . . . . . 0.4 HG23 ' O ' ' B' ' 515' ' ' ARG . 76.3 p -73.02 -36.3 66.94 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.348 0.594 . . . . 1.1799999999999999 112.401 178.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 520' ' ' VAL . . . . . 0.515 HG23 ' O ' ' B' ' 516' ' ' PHE . 55.5 t -71.25 -42.24 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 122.162 -0.336 . . . . 1.22 111.702 -174.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 521' ' ' ILE . . . . . 0.568 HG22 ' O ' ' B' ' 517' ' ' LEU . 13.5 tt -90.73 -25.83 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 115.42 1.637 . . . . 1.98 115.42 -175.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -60.77 -35.19 75.81 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.712 -0.847 . . . . 2.5699999999999998 108.712 173.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 523' ' ' ASP . . . . . 0.419 ' O ' HD23 ' B' ' 527' ' ' LEU . 22.0 m-20 -92.5 -21.44 20.14 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 115.001 1.482 . . . . 2.1699999999999999 115.001 -177.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 70.1 mt -70.69 -45.27 65.33 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.314 -0.624 . . . . 1.48 109.314 168.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 70.1 mt -52.32 -45.42 65.59 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.315 0.579 . . . . 1.95 110.962 169.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.47 -40.53 94.38 Favored Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 527' ' ' LEU . . . . . 0.419 HD23 ' O ' ' B' ' 523' ' ' ASP . 2.6 mm? -63.63 -36.14 82.83 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.036 0.446 . . . . 1.6699999999999999 111.426 175.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 40.2 t -63.54 -47.68 80.61 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.023 -0.535 . . . . 0.58999999999999997 110.699 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.67 -29.6 70.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.485 -0.78 . . . . 2.5 112.566 173.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -71.78 -54.68 9.42 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.283 0.846 . . . . 2.2400000000000002 113.283 -177.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 531' ' ' LYS . . . . . 0.563 ' HD2' HD11 ' B' ' 540' ' ' ILE . 80.0 mttt -68.73 137.89 54.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.065 -0.516 . . . . 2.2799999999999998 111.047 -177.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -96.42 160.63 14.31 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.837 -0.619 . . . . 4.21 110.158 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.47 119.58 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.848 -0.614 . . . . 0.0 114.022 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -47.02 -36.66 8.14 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.259 0.837 . . . . 2.9500000000000002 113.259 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -50.56 -51.85 44.32 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.373 -0.531 . . . . 2.2000000000000002 110.809 174.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.06 -44.83 83.37 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.62 0.6 . . . . 1.47 112.62 178.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 537' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -67.87 -31.9 72.03 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.272 -174.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 538' ' ' ALA . . . . . 0.407 ' HB2' ' CD2' ' B' ' 577' ' ' HIS . . . -68.21 -47.0 69.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.862 -0.608 . . . . 0.040000000000000001 111.048 178.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 48.4 mm -58.12 -54.98 25.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 121.549 0.69 . . . . 1.8200000000000001 111.234 173.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 540' ' ' ILE . . . . . 0.563 HD11 ' HD2' ' B' ' 531' ' ' LYS . 80.7 mt -56.75 -48.14 81.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.59 -178.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.46 -44.09 84.52 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 113.595 0.961 . . . . 0.02 113.595 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 62.3 m -60.42 -38.81 85.23 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 120.545 -0.462 . . . . 1.2 110.306 -178.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 40.5 t-20 -68.92 -47.12 66.54 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 114.365 1.246 . . . . 2.0299999999999998 114.365 -175.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 544' ' ' ILE . . . . . 0.411 HG23 HG13 ' B' ' 521' ' ' ILE . 95.1 mt -52.6 -46.06 48.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.424 -0.954 . . . . 1.8100000000000001 108.424 170.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 545' ' ' MET . . . . . 0.754 ' HB3' HG21 ' B' ' 587' ' ' THR . 45.3 mtp -63.97 -42.33 97.28 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.78 -0.768 . . . . 2.6000000000000001 112.818 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -58.35 -48.71 79.7 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 119.145 -1.022 . . . . 2.0800000000000001 109.932 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 80.8 mt -55.07 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.8 0.667 . . . . 1.5 112.8 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 548' ' ' VAL . . . . . 0.441 HG22 ' HA ' ' B' ' 545' ' ' MET . 33.8 m -47.42 -44.17 9.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.812 -0.755 . . . . 1.3999999999999999 111.427 176.265 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 549' ' ' GLY . . . . . 0.496 ' HA2' HD11 ' B' ' 591' ' ' ILE . . . -57.41 -28.08 58.9 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -86.99 -9.57 55.26 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.614 0.598 . . . . 2.27 112.614 -175.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -120.43 59.74 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.781 1.03 . . . . 3.5299999999999998 113.781 -176.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.03 -39.36 91.69 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 O-C-N 122.071 0.511 . . . . 0.46000000000000002 113.134 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 9.9 mmm180 -56.23 -46.78 79.4 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 121.169 0.509 . . . . 3.8700000000000001 109.974 -174.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -48.9 -59.84 3.25 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 123.89 0.876 . . . . 0.69999999999999996 112.101 167.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 555' ' ' LEU . . . . . . . . . . . . . 11.2 mp -54.26 -48.56 71.05 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 116.267 -0.424 . . . . 1.49 110.202 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 556' ' ' ARG . . . . . 0.484 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 78.6 ttt180 -53.93 -35.87 62.16 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 113.827 1.047 . . . . 3.0899999999999999 113.827 -178.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.06 -12.17 50.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.517 -0.473 . . . . 0.0 112.102 -177.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -128.23 78.5 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 2.9300000000000002 114.388 -177.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 33.4 p90 -50.51 -48.28 57.06 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 116.57 2.063 . . . . 3.1099999999999999 116.57 -176.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -56.57 -36.68 69.62 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.23 -0.441 . . . . 3.3199999999999998 111.136 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 561' ' ' PHE . . . . . 0.489 ' O ' HG23 ' B' ' 565' ' ' VAL . 3.5 t80 -74.89 -45.08 45.24 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.092 -1.043 . . . . 1.25 111.978 175.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 562' ' ' LEU . . . . . 0.419 ' O ' HG23 ' B' ' 566' ' ' VAL . 2.9 tt -49.99 -59.13 4.18 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 122.403 0.281 . . . . 1.3200000000000001 110.34 175.004 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 563' ' ' LYS . . . . . 0.493 ' NZ ' HD21 ' B' ' 567' ' ' ASN . 0.2 OUTLIER -50.14 -38.63 40.18 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.922 1.082 . . . . 2.7400000000000002 113.922 178.802 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 20.1 p -71.89 -39.31 69.66 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.732 -0.667 . . . . 1.24 110.356 -176.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 565' ' ' VAL . . . . . 0.489 HG23 ' O ' ' B' ' 561' ' ' PHE . 68.5 t -62.81 -41.31 92.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.685 -0.689 . . . . 1.1899999999999999 112.542 173.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 566' ' ' VAL . . . . . 0.562 HG21 ' HZ ' ' B' ' 599' ' ' PHE . 58.1 t -71.0 -50.93 39.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.542 -0.463 . . . . 1.3600000000000001 110.844 -176.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 567' ' ' ASN . . . . . 0.493 HD21 ' NZ ' ' B' ' 563' ' ' LYS . 91.1 m-20 -51.08 -37.37 45.32 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.996 -0.547 . . . . 1.9399999999999999 112.012 170.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 29.2 ttpt -72.67 -32.6 65.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.753 -0.462 . . . . 3.5299999999999998 109.753 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 569' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' B' ' 573' ' ' MET . 4.2 mp -67.46 -36.5 81.28 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.73 -0.841 . . . . 2.0099999999999998 108.73 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 570' ' ' PHE . . . . . 0.516 ' HD1' HG13 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.38 -39.38 92.17 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.872 -0.418 . . . . 3.77 109.872 178.372 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -57.66 -53.45 58.06 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 119.999 -0.68 . . . . 2.4700000000000002 110.545 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.56 -9.86 10.16 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.079 1.14 . . . . 1.23 114.079 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 573' ' ' MET . . . . . 0.924 ' HB3' HD11 ' B' ' 625' ' ' LEU . 64.0 mtt -76.42 -5.35 46.93 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.639 0.733 . . . . 2.1099999999999999 109.662 178.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -109.4 -0.48 18.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.755 -1.112 . . . . 3.2000000000000002 111.428 173.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 575' ' ' GLU . . . . . 0.445 ' HG2' HG11 ' B' ' 580' ' ' VAL . 14.4 tp10 -68.48 130.2 42.17 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.214 -0.448 . . . . 1.55 110.079 177.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 7.2 m -87.87 -21.24 25.1 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.042 0.756 . . . . 1.3999999999999999 113.042 -177.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 577' ' ' HIS . . . . . 0.576 ' HD1' ' H ' ' B' ' 578' ' ' ASP . 0.8 OUTLIER -60.22 128.03 34.75 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.411 0.624 . . . . 2.8500000000000001 112.596 -175.4 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 578' ' ' ASP . . . . . 0.576 ' H ' ' HD1' ' B' ' 577' ' ' HIS . 7.1 m-20 -44.88 125.88 5.38 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.388 -0.824 . . . . 2.1499999999999999 113.063 -171.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.26 -34.75 4.75 Favored Glycine 0 C--O 1.222 -0.627 0 N-CA-C 116.29 1.276 . . . . 0.0 116.29 174.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 580' ' ' VAL . . . . . 0.445 HG11 ' HG2' ' B' ' 575' ' ' GLU . 58.1 t -53.68 -46.42 61.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.146 0.795 . . . . 1.29 113.146 -175.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -59.6 -42.31 92.29 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.383 0.512 . . . . 1.99 112.383 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -60.54 -42.42 96.46 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.213 0.449 . . . . 2.23 112.213 172.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 25.7 mmt -60.71 -49.48 77.32 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.058 -0.257 . . . . 2.5800000000000001 110.447 175.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.86 -42.83 80.46 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.159 -0.473 . . . . 0.029999999999999999 111.79 -177.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 585' ' ' CYS . . . . . 0.464 ' SG ' ' HG3' ' B' ' 629' ' ' GLN . 23.6 p -74.4 -40.92 61.73 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 119.957 -0.697 . . . . 1.5 111.984 -177.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 586' ' ' ASP . . . . . 0.489 ' O ' HG12 ' B' ' 589' ' ' ILE . 18.0 t70 -59.53 -46.38 89.04 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.273 -0.421 . . . . 1.98 111.92 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 587' ' ' THR . . . . . 0.754 HG21 ' HB3' ' B' ' 545' ' ' MET . 40.4 p -62.19 -41.18 98.1 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.3 110.43 175.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -61.55 -32.14 72.2 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.035 -0.53 . . . . 0.53000000000000003 111.153 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 589' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 586' ' ' ASP . 41.5 pt -79.94 -35.85 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.871 -1.932 . . . . 1.97 109.76 -175.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -57.52 -50.04 74.38 Favored 'General case' 0 C--O 1.221 -0.438 0 N-CA-C 107.701 -1.222 . . . . 2.6200000000000001 107.701 176.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . 0.496 HD11 ' HA2' ' B' ' 549' ' ' GLY . 1.7 mp -63.77 -43.74 98.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.689 -0.687 . . . . 1.96 112.815 -176.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.04 93.23 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.392 -0.523 . . . . 0.0 112.301 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -62.4 -70.06 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 119.112 -1.035 . . . . 2.3599999999999999 109.793 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -56.09 -23.84 36.41 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 116.608 2.077 . . . . 2.1899999999999999 116.608 -176.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.1 p -121.68 25.25 9.38 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 114.201 1.186 . . . . 1.26 114.201 -178.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -48.46 -38.6 20.37 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 115.825 1.787 . . . . 3.5800000000000001 115.825 -172.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 597' ' ' ARG . . . . . 0.421 ' O ' HG12 ' B' ' 600' ' ' VAL . 54.8 mtp180 -69.54 -32.63 71.55 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.201 0.815 . . . . 3.7400000000000002 113.201 -175.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 598' ' ' HIS . . . . . 0.484 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 61.9 m-70 -70.2 -3.77 18.51 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.603 -0.726 . . . . 2.1400000000000001 112.05 -173.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 599' ' ' PHE . . . . . 0.562 ' HZ ' HG21 ' B' ' 566' ' ' VAL . 3.2 m-85 -105.52 -16.95 14.57 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 123.597 0.561 . . . . 2.9500000000000002 110.257 -176.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 600' ' ' VAL . . . . . 0.421 HG12 ' O ' ' B' ' 597' ' ' ARG . 15.0 p -105.76 -24.38 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.091 -0.959 . . . . 1.4199999999999999 111.319 -175.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -102.03 139.51 37.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.578 -0.849 . . . . 2.3399999999999999 111.55 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 16.1 m -60.89 122.71 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.611 -0.885 . . . . 1.3700000000000001 108.611 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -92.78 167.29 11.96 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 123.648 0.592 . . . . 2.6800000000000002 110.06 -177.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 42.9 t -71.93 128.93 35.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 N-CA-C 112.971 0.73 . . . . 1.27 112.971 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.38 6.53 64.38 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.062 -175.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 606' ' ' GLU . . . . . 0.509 ' HG2' ' H ' ' B' ' 608' ' ' MET . 34.7 tt0 -131.49 158.01 42.03 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.626 -0.83 . . . . 2.5099999999999998 110.756 175.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 19.1 t -103.28 -22.55 4.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.055 -0.975 . . . . 1.3999999999999999 112.451 -175.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 608' ' ' MET . . . . . 0.509 ' H ' ' HG2' ' B' ' 606' ' ' GLU . 96.4 mmm -136.96 142.21 37.67 Favored Pre-proline 0 C--O 1.222 -0.343 0 N-CA-C 112.615 0.598 . . . . 2.6800000000000002 112.615 -174.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 609' ' ' PRO . . . . . 0.55 ' HB2' HG22 ' B' ' 611' ' ' ILE . 10.3 Cg_endo -52.13 130.85 36.91 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 120.83 1.02 . . . . 0.42999999999999999 112.162 179.224 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -56.9 -31.85 65.3 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.866 0.321 . . . . 2.3700000000000001 111.866 -174.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 611' ' ' ILE . . . . . 0.55 HG22 ' HB2' ' B' ' 609' ' ' PRO . 6.7 tp -50.0 -44.88 22.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 CA-C-O 120.787 0.327 . . . . 1.8400000000000001 110.555 178.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 612' ' ' ASP . . . . . 0.448 ' OD1' ' HG2' ' B' ' 609' ' ' PRO . 0.9 OUTLIER -49.86 -52.0 36.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.612 0.765 . . . . 2.1499999999999999 112.875 177.698 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -59.95 -37.13 78.67 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.606 -0.438 . . . . 2.6600000000000001 110.175 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 62.7 mt -64.55 -47.96 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.117 -0.633 . . . . 1.76 111.968 178.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 615' ' ' LEU . . . . . 0.469 HD12 HD11 ' B' ' 618' ' ' ILE . 57.2 tp -62.6 -31.13 71.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.955 0.724 . . . . 1.8400000000000001 112.955 -177.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -79.57 2.11 23.46 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.599 1.333 . . . . 2.0600000000000001 114.599 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 617' ' ' ASN . . . . . 0.528 ' HB3' HG22 ' B' ' 620' ' ' THR . 12.3 m120 -142.48 15.79 2.01 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 113.104 0.779 . . . . 1.97 113.104 -174.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 618' ' ' ILE . . . . . 0.469 HD11 HD12 ' B' ' 615' ' ' LEU . 81.0 mt -46.93 -47.06 8.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 C-N-CA 118.929 -1.109 . . . . 2.0099999999999998 110.177 -176.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 619' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -63.19 -51.1 67.7 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.703 1.001 . . . . 2.2799999999999998 113.703 -176.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 620' ' ' THR . . . . . 0.528 HG22 ' HB3' ' B' ' 617' ' ' ASN . 8.8 t -56.94 -31.82 65.35 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.46 -0.896 . . . . 1.3200000000000001 110.741 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 621' ' ' ILE . . . . . 0.516 HG13 ' HD1' ' B' ' 570' ' ' PHE . 15.7 tt -79.36 -42.67 23.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 115.267 1.58 . . . . 2.0 115.267 -178.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 622' ' ' ILE . . . . . 0.829 ' HA ' HD13 ' B' ' 625' ' ' LEU . 0.2 OUTLIER -87.7 -6.27 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.011 1.485 . . . . 2.0899999999999999 115.011 -177.586 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.7 t -20.05 -58.28 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 116.538 2.051 . . . . 1.47 116.538 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -99.33 -7.53 26.16 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.061 -1.427 . . . . 2.0699999999999998 111.007 -163.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 625' ' ' LEU . . . . . 0.924 HD11 ' HB3' ' B' ' 573' ' ' MET . 9.0 mp -71.87 146.85 47.64 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 123.326 0.391 . . . . 1.6699999999999999 111.769 -173.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 626' ' ' GLN . . . . . 0.504 ' O ' HG23 ' B' ' 630' ' ' VAL . 11.8 pt20 -76.69 162.08 71.8 Favored Pre-proline 0 CA--C 1.519 -0.22 0 N-CA-C 108.843 -0.799 . . . . 2.3500000000000001 108.843 174.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 627' ' ' PRO . . . . . 0.405 ' HD2' ' HB2' ' B' ' 626' ' ' GLN . 85.2 Cg_exo -47.86 -43.63 29.0 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.792 1.42 . . . . 0.44 115.792 -178.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -67.29 -43.07 82.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.573 -0.528 . . . . 2.6200000000000001 109.573 -174.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 629' ' ' GLN . . . . . 0.464 ' HG3' ' SG ' ' B' ' 585' ' ' CYS . 1.1 mp0 -63.18 -38.37 90.89 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.934 -0.575 . . . . 2.0600000000000001 110.928 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 630' ' ' VAL . . . . . 0.517 HG22 HG12 ' B' ' 622' ' ' ILE . 59.8 t . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.207 -0.901 . . . . 1.3 110.687 176.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 112.525 -0.23 . . . . 9.8599999999999994 112.525 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 78.0 p -85.6 -56.36 3.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.742 0.306 . . . . 8.7799999999999994 110.978 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 58.52 88.03 0.07 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.207 -0.451 . . . . 6.8200000000000003 111.377 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.7 t -74.85 -68.3 0.56 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 6.25 110.737 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -178.83 154.02 13.53 Favored Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.84 -0.695 . . . . 4.1200000000000001 112.623 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -167.26 -38.96 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.905 0.383 . . . . 4.0300000000000002 110.584 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.598 HD13 HD22 ' A' ' 10' ' ' LEU . 3.9 mm? -61.58 -15.59 40.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.948 -0.569 . . . . 2.21 111.25 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -64.78 -35.35 80.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 3.79 111.311 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -78.78 -23.71 45.08 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.415 -0.357 . . . . 4.1699999999999999 110.727 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.598 HD22 HD13 ' A' ' 7' ' ' LEU . 9.6 mp -76.75 -13.37 60.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.144 -0.48 . . . . 2.5800000000000001 110.727 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.02 -42.17 24.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.027 -0.533 . . . . 2.8399999999999999 111.344 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.9 tp -59.61 -22.89 62.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.249 -0.432 . . . . 3.6699999999999999 111.249 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.456 ' O ' HD21 ' B' ' 525' ' ' LEU . 75.0 mmtt -71.11 -48.25 53.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.381 -0.372 . . . . 4.9299999999999997 110.901 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.516 HD12 HD13 ' B' ' 525' ' ' LEU . 56.4 tp -57.44 -19.97 27.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.451 . . . . 3.27 111.154 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.81 -15.36 20.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.267 -0.424 . . . . 3.1299999999999999 111.278 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -103.78 79.33 0.31 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.93 -0.652 . . . . 2.4700000000000002 112.535 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.466 HD22 ' HZ ' ' B' ' 572' ' ' PHE . 5.2 tt -142.98 90.43 2.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.75 0.31 . . . . 2.1400000000000001 110.492 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -85.76 162.53 18.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 3.9199999999999999 110.847 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 13.9 tt -166.41 -37.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.506 . . . . 3.25 110.954 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.401 ' O ' ' N ' ' A' ' 22' ' ' THR . 27.2 t-20 -150.15 -88.68 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 5.9500000000000002 110.756 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.4 ttmp? 53.8 -87.7 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.467 -0.333 . . . . 9.3900000000000006 111.143 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.401 ' N ' ' O ' ' A' ' 20' ' ' ASN . 88.8 m -128.0 -75.55 0.57 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.426 -0.352 . . . . 8.9700000000000006 111.055 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 59.19 83.72 0.12 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.091 -0.504 . . . . 11.67 111.042 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -104.35 39.18 2.92 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.878 -0.677 . . . . 12.859999999999999 112.756 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -113.68 145.52 41.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.696 0.284 . . . . 15.369999999999999 110.804 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.75 -177.58 5.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.326 -0.397 . . . . 16.539999999999999 111.052 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 76.7 m . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.316 -0.85 . . . . 17.93 110.867 -179.987 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 39.5 pt . . . . . 0 C--O 1.236 0.342 0 N-CA-C 113.024 0.75 . . . . 2.1299999999999999 113.024 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 80.5 p -48.89 119.18 3.01 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.576 0.584 . . . . 1.29 112.576 174.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.82 1.43 67.84 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 120.913 -0.66 . . . . 0.0 114.476 -179.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.33 -7.63 41.25 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 117.659 0.73 . . . . 0.02 112.431 176.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 86.4 mtp -112.41 159.96 18.2 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.29 0.478 . . . . 2.21 112.29 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -69.67 134.24 48.46 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 109.146 -0.687 . . . . 2.6699999999999999 109.146 174.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -41.71 -35.42 0.78 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.37 0.878 . . . . 2.6600000000000001 113.37 -173.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -73.84 -41.89 61.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.584 -0.734 . . . . 2.4399999999999999 112.07 -176.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -64.83 -40.11 94.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.158 0.504 . . . . 2.0800000000000001 110.88 171.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -53.72 -48.58 69.46 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.303 -0.862 . . . . 1.9199999999999999 111.205 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -54.85 -57.6 10.94 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 111.9 0.333 . . . . 2.73 111.9 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . 0.479 ' O ' HG12 ' B' ' 518' ' ' VAL . 81.2 mtp180 -56.63 -35.93 68.9 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.157 0.911 . . . . 3.75 111.086 -177.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.699 ' O ' HG13 ' B' ' 520' ' ' VAL . 76.5 t80 -76.14 -45.56 33.01 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.104 -0.953 . . . . 1.8899999999999999 110.504 -173.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 517' ' ' LEU . . . . . 0.759 ' HA ' HG22 ' B' ' 520' ' ' VAL . 8.5 tp -66.76 -32.23 73.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.731 -0.668 . . . . 1.8999999999999999 112.591 177.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 518' ' ' VAL . . . . . 0.479 HG12 ' O ' ' B' ' 515' ' ' ARG . 7.7 p -67.57 -35.07 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 118.483 -1.287 . . . . 1.3999999999999999 109.021 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 42.8 m -72.9 -36.38 67.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.41 0.624 . . . . 1.1799999999999999 112.444 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 520' ' ' VAL . . . . . 0.786 HG23 HG13 ' B' ' 521' ' ' ILE . 25.5 m -71.21 -42.3 75.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.395 -0.366 . . . . 1.22 111.636 -174.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 521' ' ' ILE . . . . . 0.786 HG13 HG23 ' B' ' 520' ' ' VAL . 82.4 mt -90.69 -25.86 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 N-CA-C 115.418 1.636 . . . . 1.98 115.418 -175.097 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -60.82 -35.16 75.81 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.717 -0.845 . . . . 2.5699999999999998 108.717 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -92.4 -21.62 20.11 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.032 1.493 . . . . 2.1699999999999999 115.032 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 524' ' ' LEU . . . . . 0.635 HD23 ' HB ' ' B' ' 544' ' ' ILE . 16.4 tp -70.53 -45.45 65.51 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 109.325 -0.621 . . . . 1.48 109.325 168.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . 0.516 HD13 HD12 ' A' ' 14' ' ' LEU . 43.2 tp -52.15 -45.52 65.06 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-O 121.211 0.529 . . . . 1.95 110.953 169.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.46 -40.57 94.42 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . 0.401 HD23 HD12 ' B' ' 540' ' ' ILE . 52.2 tp -63.53 -36.16 82.87 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.057 0.456 . . . . 1.6699999999999999 111.483 175.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 49.9 t -63.47 -47.74 80.58 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.012 -0.54 . . . . 0.58999999999999997 110.705 -175.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -61.68 -29.65 70.22 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.508 -0.769 . . . . 2.5 112.56 173.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -71.65 -54.71 9.49 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.369 0.877 . . . . 2.2400000000000002 113.369 -177.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -68.76 137.99 54.49 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.98 -0.555 . . . . 2.2799999999999998 111.031 -177.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -96.49 160.72 14.25 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.749 -0.66 . . . . 4.21 110.19 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.64 1.35 Allowed Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.912 -0.585 . . . . 0.0 114.031 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -47.18 -36.61 8.89 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 113.175 0.805 . . . . 2.9500000000000002 113.175 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -50.53 -51.86 43.88 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.376 -0.53 . . . . 2.2000000000000002 110.823 174.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -66.05 -44.85 83.37 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.62 0.6 . . . . 1.47 112.62 178.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 537' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -67.87 -31.95 72.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.272 -174.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.12 -46.96 69.45 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 115.815 -0.629 . . . . 0.040000000000000001 111.149 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 74.4 mt -58.24 -54.9 26.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 1.8200000000000001 111.218 173.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 540' ' ' ILE . . . . . 0.401 HD12 HD23 ' B' ' 527' ' ' LEU . 47.0 mm -56.73 -48.17 81.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.601 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 541' ' ' ALA . . . . . 0.412 ' O ' ' CG2' ' B' ' 544' ' ' ILE . . . -57.48 -43.98 84.54 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 113.599 0.963 . . . . 0.02 113.599 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 542' ' ' SER . . . . . 0.56 ' HA ' ' HE3' ' B' ' 545' ' ' MET . 92.5 p -60.54 -38.7 85.31 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.557 -0.457 . . . . 1.2 110.301 -178.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -69.1 -47.07 66.14 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 114.298 1.221 . . . . 2.0299999999999998 114.298 -175.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 544' ' ' ILE . . . . . 0.635 ' HB ' HD23 ' B' ' 524' ' ' LEU . 7.8 tt -52.6 -45.92 48.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 108.52 -0.919 . . . . 1.8100000000000001 108.52 170.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 545' ' ' MET . . . . . 0.56 ' HE3' ' HA ' ' B' ' 542' ' ' SER . 74.5 mtm -64.03 -42.33 97.13 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.744 -0.782 . . . . 2.6000000000000001 112.766 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -58.39 -48.73 79.68 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 119.224 -0.991 . . . . 2.0800000000000001 109.838 176.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 36.1 mm -55.05 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.794 0.664 . . . . 1.5 112.794 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 548' ' ' VAL . . . . . 0.621 HG22 HD11 ' B' ' 555' ' ' LEU . 9.3 p -47.36 -44.21 8.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 C-N-CA 119.77 -0.772 . . . . 1.3999999999999999 111.488 176.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.05 58.85 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.845 -0.534 . . . . 0.0 112.908 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 550' ' ' GLN . . . . . 0.459 ' C ' ' HD3' ' B' ' 552' ' ' PRO . 16.1 mm100 -87.06 -9.56 55.14 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.617 0.599 . . . . 2.27 112.617 -175.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -120.39 59.67 7.01 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.807 1.04 . . . . 3.5299999999999998 113.807 -177.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 552' ' ' PRO . . . . . 0.459 ' HD3' ' C ' ' B' ' 550' ' ' GLN . 34.4 Cg_exo -55.98 -39.34 91.81 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.068 0.509 . . . . 0.46000000000000002 113.152 177.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -56.3 -46.65 79.72 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-O 121.164 0.507 . . . . 3.8700000000000001 109.997 -174.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -49.02 -59.64 3.45 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 123.931 0.892 . . . . 0.69999999999999996 112.158 167.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 555' ' ' LEU . . . . . 0.621 HD11 HG22 ' B' ' 548' ' ' VAL . 82.2 mt -54.41 -48.51 71.53 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 116.271 -0.422 . . . . 1.49 110.195 -179.003 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . 0.547 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 56.0 ttt180 -53.98 -35.82 62.24 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.833 1.049 . . . . 3.0899999999999999 113.833 -178.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.05 -12.18 50.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.538 -0.465 . . . . 0.0 112.106 -177.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 558' ' ' HIS . . . . . 0.418 ' CG ' ' HG ' ' A' ' 7' ' ' LEU . 51.0 m-70 -128.21 78.51 1.84 Allowed 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.393 1.257 . . . . 2.9300000000000002 114.393 -177.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 5.6 m-90 -50.63 -48.22 58.15 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.492 2.034 . . . . 3.1099999999999999 116.492 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -56.68 -36.56 69.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.423 . . . . 3.3199999999999998 111.152 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 561' ' ' PHE . . . . . 0.516 ' O ' HG23 ' B' ' 565' ' ' VAL . 1.4 t80 -74.92 -45.12 44.7 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.126 -1.03 . . . . 1.25 111.882 175.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . 0.638 HD12 HD11 ' B' ' 591' ' ' ILE . 26.2 tp -50.01 -59.09 4.22 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 122.44 0.296 . . . . 1.3200000000000001 110.314 175.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -50.24 -38.63 41.57 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.864 1.061 . . . . 2.7400000000000002 113.864 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 564' ' ' THR . . . . . 0.471 HG22 HD23 ' A' ' 14' ' ' LEU . 89.9 m -71.73 -39.42 70.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.583 0.706 . . . . 1.24 110.413 -176.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 565' ' ' VAL . . . . . 0.516 HG23 ' O ' ' B' ' 561' ' ' PHE . 59.3 t -62.81 -41.34 92.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-N 115.667 -0.697 . . . . 1.1899999999999999 112.529 173.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 566' ' ' VAL . . . . . 0.479 HG23 ' O ' ' B' ' 562' ' ' LEU . 42.3 t -70.94 -50.82 40.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 120.49 -0.484 . . . . 1.3600000000000001 110.873 -176.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -51.1 -37.48 46.12 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.075 -0.512 . . . . 1.9399999999999999 111.978 170.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 568' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' B' ' 568' ' ' LYS . 25.5 mmtp -72.55 -32.73 66.31 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.723 -0.473 . . . . 3.5299999999999998 109.723 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 569' ' ' LEU . . . . . 0.429 ' O ' ' HG3' ' B' ' 573' ' ' MET . 57.1 mt -67.52 -36.43 81.02 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 108.66 -0.867 . . . . 2.0099999999999998 108.66 177.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 570' ' ' PHE . . . . . 0.426 ' CE2' HG12 ' B' ' 566' ' ' VAL . 16.2 m-85 -65.4 -39.38 92.11 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.859 -0.423 . . . . 3.77 109.859 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -57.69 -53.53 57.13 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.881 -0.727 . . . . 2.4700000000000002 110.483 176.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 572' ' ' PHE . . . . . 0.466 ' HZ ' HD22 ' A' ' 17' ' ' LEU . 54.0 m-85 -62.39 -9.89 9.7 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.158 1.17 . . . . 1.23 114.158 -177.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 573' ' ' MET . . . . . 0.82 ' HB3' HD11 ' B' ' 625' ' ' LEU . 26.5 mtm -76.42 -5.29 46.69 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.671 0.748 . . . . 2.1099999999999999 109.667 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -109.49 -0.59 18.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.765 -1.107 . . . . 3.2000000000000002 111.395 173.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 575' ' ' GLU . . . . . 0.462 ' HG2' HG11 ' B' ' 580' ' ' VAL . 18.6 tp10 -68.46 130.26 42.36 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.233 -0.44 . . . . 1.55 110.188 177.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 10.2 t -87.88 -21.34 25.04 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 112.947 0.721 . . . . 1.3999999999999999 112.947 -177.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -60.17 128.01 34.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.48 0.657 . . . . 2.8500000000000001 112.516 -175.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -44.81 125.83 5.28 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.391 -0.822 . . . . 2.1499999999999999 113.095 -171.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.62 4.83 Favored Glycine 0 C--O 1.223 -0.57 0 N-CA-C 116.294 1.278 . . . . 0.0 116.294 174.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 580' ' ' VAL . . . . . 0.462 HG11 ' HG2' ' B' ' 575' ' ' GLU . 43.1 t -53.88 -46.35 63.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 113.057 0.762 . . . . 1.29 113.057 -175.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.653 ' NE2' ' H ' ' B' ' 581' ' ' GLN . 0.1 OUTLIER -59.64 -42.25 92.34 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.409 0.522 . . . . 1.99 112.409 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -60.54 -42.45 96.54 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.159 0.429 . . . . 2.23 112.159 172.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 583' ' ' MET . . . . . 0.454 ' HG2' ' HA ' ' B' ' 542' ' ' SER . 3.1 tpt -60.7 -49.53 77.15 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 121.058 -0.257 . . . . 2.5800000000000001 110.416 175.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.89 80.29 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.181 -0.463 . . . . 0.029999999999999999 111.744 -177.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 81.2 m -74.44 -40.92 61.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 119.976 -0.69 . . . . 1.5 111.938 -177.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 586' ' ' ASP . . . . . 0.639 ' O ' HG22 ' B' ' 589' ' ' ILE . 2.0 m-20 -59.6 -46.32 89.3 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.273 -0.421 . . . . 1.98 111.974 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 87.2 m -62.16 -41.22 98.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.3 110.43 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 588' ' ' PHE . . . . . 0.587 ' O ' HG22 ' B' ' 591' ' ' ILE . 87.8 t80 -61.4 -32.22 72.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.047 -0.524 . . . . 0.53000000000000003 111.232 -177.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 589' ' ' ILE . . . . . 0.639 HG22 ' O ' ' B' ' 586' ' ' ASP . 9.7 tp -79.91 -35.99 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.871 -1.932 . . . . 1.97 109.74 -175.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -57.41 -50.04 74.3 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 107.752 -1.203 . . . . 2.6200000000000001 107.752 176.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . 0.638 HD11 HD12 ' B' ' 562' ' ' LEU . 12.2 tt -63.75 -43.72 98.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 112.885 0.698 . . . . 1.96 112.885 -177.062 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.94 -39.12 93.42 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.407 -0.517 . . . . 0.0 112.275 177.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -62.32 -70.08 0.22 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 119.113 -1.035 . . . . 2.3599999999999999 109.848 174.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 594' ' ' LYS . . . . . 0.478 ' HD2' ' N ' ' B' ' 594' ' ' LYS . 13.5 mptt -56.15 -23.76 36.82 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 116.56 2.059 . . . . 2.1899999999999999 116.56 -176.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.1 p -121.76 25.29 9.31 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.222 1.193 . . . . 1.26 114.222 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -48.61 -38.45 20.92 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.838 1.792 . . . . 3.5800000000000001 115.838 -172.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . 0.407 ' O ' HG22 ' B' ' 600' ' ' VAL . 38.7 mmt180 -69.56 -32.61 71.5 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.202 0.816 . . . . 3.7400000000000002 113.202 -175.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 598' ' ' HIS . . . . . 0.547 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 89.4 m-70 -70.21 -3.81 18.68 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.588 -0.733 . . . . 2.1400000000000001 112.052 -173.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 599' ' ' PHE . . . . . 0.518 ' O ' HG23 ' B' ' 611' ' ' ILE . 8.7 m-85 -105.64 -16.81 14.59 Favored 'General case' 0 CA--C 1.517 -0.301 0 O-C-N 123.621 0.576 . . . . 2.9500000000000002 110.204 -176.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . 0.455 HG12 HD13 ' B' ' 611' ' ' ILE . 34.5 m -105.85 -24.37 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 115.084 -0.962 . . . . 1.4199999999999999 111.355 -175.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -102.0 139.46 37.6 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 119.504 -0.879 . . . . 2.3399999999999999 111.661 176.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 4.8 p -60.86 122.81 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 N-CA-C 108.639 -0.874 . . . . 1.3700000000000001 108.639 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 603' ' ' GLN . . . . . 0.451 HE21 ' HB2' ' B' ' 603' ' ' GLN . 0.0 OUTLIER -92.88 167.33 11.91 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 123.645 0.591 . . . . 2.6800000000000002 110.049 -177.589 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 30.8 t -71.91 128.81 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 113.022 0.749 . . . . 1.27 113.022 -175.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.46 6.57 64.2 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.062 -175.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 606' ' ' GLU . . . . . 0.569 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.0 tp10 -131.45 158.08 41.79 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.626 -0.83 . . . . 2.5099999999999998 110.772 175.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 40.3 t -103.34 -22.57 4.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.04 -0.982 . . . . 1.3999999999999999 112.527 -175.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 608' ' ' MET . . . . . 0.569 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 22.7 ptp -136.92 142.25 37.88 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.611 0.597 . . . . 2.6800000000000002 112.611 -174.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.11 130.9 37.05 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.889 1.06 . . . . 0.42999999999999999 112.085 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 610' ' ' PHE . . . . . 0.434 ' CE2' HD11 ' B' ' 614' ' ' ILE . 16.4 t80 -57.04 -31.8 65.54 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.794 0.294 . . . . 2.3700000000000001 111.794 -174.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 611' ' ' ILE . . . . . 0.518 HG23 ' O ' ' B' ' 599' ' ' PHE . 8.9 pt -50.14 -44.71 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 120.811 0.339 . . . . 1.8400000000000001 110.591 178.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -49.93 -52.05 36.32 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.666 0.786 . . . . 2.1499999999999999 112.844 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -59.91 -37.09 78.45 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.562 -0.455 . . . . 2.6600000000000001 110.241 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 614' ' ' ILE . . . . . 0.434 HD11 ' CE2' ' B' ' 610' ' ' PHE . 24.5 mm -64.51 -47.97 86.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.934 0 C-N-CA 120.118 -0.633 . . . . 1.76 112.013 178.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 9.9 tt -62.69 -31.08 71.92 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.978 0.733 . . . . 1.8400000000000001 112.978 -177.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -79.54 2.12 23.36 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.621 1.341 . . . . 2.0600000000000001 114.621 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 617' ' ' ASN . . . . . 0.625 HD22 ' C ' ' B' ' 617' ' ' ASN . 0.2 OUTLIER -142.44 15.68 2.02 Favored 'General case' 0 C--O 1.242 0.685 0 N-CA-C 113.138 0.792 . . . . 1.97 113.138 -174.235 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 618' ' ' ILE . . . . . 0.494 ' O ' HG12 ' B' ' 621' ' ' ILE . 10.5 tt -46.97 -46.99 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 C-N-CA 118.921 -1.112 . . . . 2.0099999999999998 110.17 -176.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 619' ' ' ASN . . . . . 0.455 ' N ' HG23 ' B' ' 618' ' ' ILE . 78.2 m-20 -63.2 -51.05 67.88 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 113.785 1.031 . . . . 2.2799999999999998 113.785 -176.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 48.5 p -56.97 -31.83 65.42 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 119.432 -0.907 . . . . 1.3200000000000001 110.708 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 621' ' ' ILE . . . . . 0.494 HG12 ' O ' ' B' ' 618' ' ' ILE . 27.7 pt -79.3 -42.68 23.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.282 1.586 . . . . 2.0 115.282 -178.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 622' ' ' ILE . . . . . 0.708 ' HA ' HD13 ' B' ' 625' ' ' LEU . 2.8 pp -87.72 -6.21 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 115.035 1.494 . . . . 2.0899999999999999 115.035 -177.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 18.9 p -20.03 -58.34 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 116.493 2.035 . . . . 1.47 116.493 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.23 -7.58 26.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.011 -1.45 . . . . 2.0699999999999998 111.022 -163.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 625' ' ' LEU . . . . . 0.82 HD11 ' HB3' ' B' ' 573' ' ' MET . 9.1 mp -71.83 146.9 47.69 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 123.3 0.375 . . . . 1.6699999999999999 111.662 -173.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 626' ' ' GLN . . . . . 0.433 ' O ' HG23 ' B' ' 630' ' ' VAL . 1.8 mp0 -76.85 162.1 71.45 Favored Pre-proline 0 N--CA 1.464 0.254 0 N-CA-C 108.794 -0.817 . . . . 2.3500000000000001 108.794 174.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -47.78 -43.67 28.48 Favored 'Trans proline' 0 C--O 1.233 0.256 0 N-CA-C 115.799 1.423 . . . . 0.44 115.799 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -67.24 -43.03 82.97 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.423 -0.511 . . . . 2.6200000000000001 109.66 -174.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 629' ' ' GLN . . . . . 0.456 HE22 ' HB3' ' B' ' 581' ' ' GLN . 27.5 mt-30 -63.27 -38.34 90.78 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 115.98 -0.555 . . . . 2.0600000000000001 110.923 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 630' ' ' VAL . . . . . 0.433 HG23 ' O ' ' B' ' 626' ' ' GLN . 97.8 t . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.163 -0.922 . . . . 1.3 110.722 176.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.196 0 N-CA-C 112.404 -0.278 . . . . 9.8599999999999994 112.404 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.2 t -147.9 119.17 7.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.732 0.301 . . . . 8.7799999999999994 110.866 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 56.16 78.67 0.19 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.096 -0.502 . . . . 6.8200000000000003 111.097 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.4 m -98.17 22.89 8.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 6.25 110.823 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -85.88 48.39 3.96 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.717 -0.754 . . . . 4.1200000000000001 112.466 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -138.32 -9.55 1.48 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.783 0.325 . . . . 4.0300000000000002 110.995 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.617 HD21 ' HB2' ' B' ' 561' ' ' PHE . 1.7 tp -59.7 -19.71 51.56 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.221 -0.445 . . . . 2.21 110.9 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -58.4 -42.42 87.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.213 -0.449 . . . . 3.79 111.249 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -66.85 -20.83 66.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.828 0.347 . . . . 4.1699999999999999 110.873 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.547 HD12 HD12 ' A' ' 7' ' ' LEU . 48.4 mt -78.72 -28.88 45.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.125 -0.488 . . . . 2.5800000000000001 110.683 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.59 -36.8 79.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.476 . . . . 2.8399999999999999 111.398 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.32 -9.97 59.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.277 -0.419 . . . . 3.6699999999999999 111.407 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 37.3 tptt -80.45 -50.15 10.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.569 -0.287 . . . . 4.9299999999999997 111.176 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.44 HD11 ' HG2' ' B' ' 568' ' ' LYS . 59.7 tp -79.46 -23.76 42.85 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.537 -0.301 . . . . 3.27 110.871 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.57 -16.12 45.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.285 -0.416 . . . . 3.1299999999999999 111.281 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -126.61 39.05 2.06 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.89 -0.672 . . . . 2.4700000000000002 112.606 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.486 ' HB3' ' HD3' ' B' ' 568' ' ' LYS . 62.4 tp -71.4 121.12 18.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.798 0.332 . . . . 2.1400000000000001 110.431 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -98.37 169.34 9.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.084 -0.507 . . . . 3.9199999999999999 111.378 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.65 HG13 ' HB2' ' B' ' 537' ' ' LYS . 13.8 tt -167.27 -34.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.685 -0.689 . . . . 3.25 110.363 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -115.87 19.5 15.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.962 -0.563 . . . . 5.9500000000000002 110.514 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 97.2 mttt 60.2 172.74 0.09 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.922 -0.581 . . . . 9.3900000000000006 111.295 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.4 p -133.53 -43.49 0.84 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.104 -0.498 . . . . 8.9700000000000006 111.084 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.429 ' H ' ' H ' ' A' ' 24' ' ' GLY . 11.8 pt-20 -167.26 -15.07 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.133 -0.485 . . . . 11.67 110.93 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.429 ' H ' ' H ' ' A' ' 23' ' ' GLU . . . 88.27 136.46 5.41 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.849 -0.691 . . . . 12.859999999999999 112.593 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 57.14 89.21 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.894 0.378 . . . . 15.369999999999999 111.16 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -81.87 104.52 12.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.112 -0.495 . . . . 16.539999999999999 110.921 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.4 p . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.209 -0.9 . . . . 17.93 110.923 -179.975 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 504' ' ' ILE . . . . . 0.436 ' N ' HD13 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.236 0.386 0 N-CA-C 113.063 0.764 . . . . 2.1299999999999999 113.063 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . 0.464 ' HB3' ' HG3' ' B' ' 550' ' ' GLN . 79.8 p -48.85 119.11 2.95 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.549 0.574 . . . . 1.29 112.549 174.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.88 1.43 67.69 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.964 -0.636 . . . . 0.0 114.407 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.55 41.43 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.646 0.723 . . . . 0.02 112.443 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 54.6 mtt -112.42 160.01 18.16 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 112.32 0.489 . . . . 2.21 112.32 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -69.78 134.21 48.3 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.131 -0.692 . . . . 2.6699999999999999 109.131 174.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -41.72 -35.44 0.79 Allowed 'General case' 0 C--O 1.241 0.623 0 N-CA-C 113.361 0.874 . . . . 2.6600000000000001 113.361 -173.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -73.67 -41.98 61.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.546 -0.752 . . . . 2.4399999999999999 112.152 -176.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -64.83 -40.11 94.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.145 0.498 . . . . 2.0800000000000001 110.885 171.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . 0.524 ' HG3' HD23 ' B' ' 517' ' ' LEU . 9.1 tp10 -53.71 -48.66 69.36 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.365 -0.834 . . . . 1.9199999999999999 111.108 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 514' ' ' LYS . . . . . 0.528 ' O ' ' HG ' ' B' ' 517' ' ' LEU . 62.9 mttp -54.81 -57.57 11.05 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 111.918 0.34 . . . . 2.73 111.918 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . 0.442 ' O ' HG12 ' B' ' 518' ' ' VAL . 39.8 ttm180 -56.61 -36.0 68.93 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 124.201 0.938 . . . . 3.75 111.092 -177.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.506 ' O ' HG23 ' B' ' 520' ' ' VAL . 88.8 t80 -76.02 -45.64 33.45 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.06 -0.973 . . . . 1.8899999999999999 110.554 -173.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 517' ' ' LEU . . . . . 0.566 HD12 ' N ' ' B' ' 518' ' ' VAL . 4.4 pp -66.63 -32.26 73.47 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.708 -0.678 . . . . 1.8999999999999999 112.674 177.087 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 518' ' ' VAL . . . . . 0.566 ' N ' HD12 ' B' ' 517' ' ' LEU . 7.7 p -67.53 -35.09 72.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 118.483 -1.287 . . . . 1.3999999999999999 109.047 178.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 60.8 p -73.01 -36.33 66.99 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.1799999999999999 112.391 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 520' ' ' VAL . . . . . 0.506 HG23 ' O ' ' B' ' 516' ' ' PHE . 56.0 t -71.23 -42.37 75.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.46 -0.336 . . . . 1.22 111.611 -174.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 521' ' ' ILE . . . . . 0.52 HG22 ' O ' ' B' ' 517' ' ' LEU . 14.5 tt -90.64 -25.75 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.492 1.664 . . . . 1.98 115.492 -175.116 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -60.83 -35.28 76.15 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.683 -0.858 . . . . 2.5699999999999998 108.683 173.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -92.36 -21.5 20.21 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.02 1.489 . . . . 2.1699999999999999 115.02 -177.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 524' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' B' ' 520' ' ' VAL . 84.2 mt -70.58 -45.46 65.34 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 109.28 -0.637 . . . . 1.48 109.28 168.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 84.6 mt -52.18 -45.46 65.15 Favored 'General case' 0 C--O 1.246 0.912 0 CA-C-O 121.329 0.585 . . . . 1.95 110.97 169.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . 0.426 ' O ' ' HG2' ' B' ' 529' ' ' GLU . . . -66.5 -40.59 94.34 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 -178.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 67.2 mt -63.57 -36.07 82.6 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 1.6699999999999999 111.47 175.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 528' ' ' CYS . . . . . 0.455 ' SG ' HD11 ' A' ' 17' ' ' LEU . 47.6 t -63.55 -47.73 80.37 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.08 -0.509 . . . . 0.58999999999999997 110.661 -175.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 529' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' B' ' 526' ' ' GLY . 11.1 pt-20 -61.71 -29.59 70.2 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.508 -0.769 . . . . 2.5 112.589 173.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -71.61 -54.84 9.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.322 0.86 . . . . 2.2400000000000002 113.322 -177.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 531' ' ' LYS . . . . . 0.465 ' O ' ' HD3' ' B' ' 537' ' ' LYS . 31.6 mmmt -68.71 137.87 54.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.994 -0.548 . . . . 2.2799999999999998 111.047 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 19.1 ptt180 -96.37 160.67 14.29 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.79 -0.641 . . . . 4.21 110.149 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.39 119.58 1.34 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.841 -0.618 . . . . 0.0 114.008 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 534' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 19' ' ' ILE . 51.5 mtmt -47.06 -36.63 8.32 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.248 0.832 . . . . 2.9500000000000002 113.248 177.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -50.53 -51.89 43.68 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.397 -0.521 . . . . 2.2000000000000002 110.824 174.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 536' ' ' ASN . . . . . 0.424 ' O ' ' CG1' ' B' ' 539' ' ' ILE . 32.0 m-80 -65.98 -44.86 83.64 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.697 0.628 . . . . 1.47 112.697 178.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 537' ' ' LYS . . . . . 0.65 ' HB2' HG13 ' A' ' 19' ' ' ILE . 5.3 mmmm -67.84 -32.02 72.26 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.263 -174.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.03 -47.04 69.52 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 115.889 -0.596 . . . . 0.040000000000000001 111.156 178.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 539' ' ' ILE . . . . . 0.47 HG13 ' N ' ' B' ' 540' ' ' ILE . 43.5 pt -58.15 -54.93 25.79 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 1.8200000000000001 111.224 173.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 540' ' ' ILE . . . . . 0.47 ' N ' HG13 ' B' ' 539' ' ' ILE . 87.1 mt -56.85 -48.09 81.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 121.7 -0.625 . . . . 1.8500000000000001 110.57 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 541' ' ' ALA . . . . . 0.475 ' O ' HG12 ' B' ' 544' ' ' ILE . . . -57.35 -44.17 84.1 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 113.678 0.992 . . . . 0.02 113.678 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 95.8 p -60.33 -38.83 84.97 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 120.658 -0.417 . . . . 1.2 110.294 -178.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -69.0 -47.12 66.28 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.339 1.237 . . . . 2.0299999999999998 114.339 -175.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 544' ' ' ILE . . . . . 0.53 HG13 ' N ' ' B' ' 545' ' ' MET . 47.1 pt -52.69 -45.89 49.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.515 -0.921 . . . . 1.8100000000000001 108.515 170.075 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 545' ' ' MET . . . . . 0.818 ' HB3' HG21 ' B' ' 587' ' ' THR . 77.0 mtm -64.06 -42.34 97.04 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.761 -0.776 . . . . 2.6000000000000001 112.786 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -58.26 -48.82 79.23 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 119.279 -0.969 . . . . 2.0800000000000001 109.857 176.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 28.9 mm -55.04 -61.41 1.05 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 112.862 0.69 . . . . 1.5 112.862 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 548' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' B' ' 545' ' ' MET . 33.4 m -47.32 -44.18 8.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 C-N-CA 119.872 -0.731 . . . . 1.3999999999999999 111.498 176.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.53 -27.95 59.07 Favored Glycine 0 C--N 1.331 0.285 0 O-C-N 121.835 -0.541 . . . . 0.0 112.851 -177.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 550' ' ' GLN . . . . . 0.464 ' HG3' ' HB3' ' B' ' 505' ' ' SER . 21.8 tp60 -87.13 -9.52 55.09 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.613 0.598 . . . . 2.27 112.613 -175.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 551' ' ' TYR . . . . . 0.482 ' O ' HD23 ' B' ' 555' ' ' LEU . 74.3 m-85 -120.36 59.72 6.98 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.809 1.04 . . . . 3.5299999999999998 113.809 -177.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.01 -39.3 92.03 Favored 'Trans proline' 0 CA--C 1.53 0.298 0 O-C-N 122.127 0.54 . . . . 0.46000000000000002 113.143 177.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 15.5 ptp180 -56.35 -46.71 79.84 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 121.095 0.474 . . . . 3.8700000000000001 109.931 -174.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -48.89 -59.8 3.28 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 123.958 0.903 . . . . 0.69999999999999996 112.113 167.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 555' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' B' ' 562' ' ' LEU . 4.4 mm? -54.34 -48.51 71.33 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 116.242 -0.436 . . . . 1.49 110.236 -178.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 63.1 mtp180 -53.93 -35.79 62.09 Favored 'General case' 0 C--O 1.243 0.757 0 N-CA-C 113.828 1.047 . . . . 3.0899999999999999 113.828 -178.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.13 -12.14 50.74 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.486 -0.486 . . . . 0.0 112.058 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 558' ' ' HIS . . . . . 0.429 ' ND1' HD22 ' A' ' 7' ' ' LEU . 86.8 m-70 -128.27 78.51 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.399 1.259 . . . . 2.9300000000000002 114.399 -177.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 559' ' ' TRP . . . . . 0.504 ' O ' ' HG2' ' B' ' 563' ' ' LYS . 31.8 m-90 -50.46 -48.32 56.56 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 116.563 2.06 . . . . 3.1099999999999999 116.563 -176.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 560' ' ' LYS . . . . . 0.426 ' O ' HG23 ' B' ' 564' ' ' THR . 63.6 mttp -56.67 -36.6 69.77 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.314 -0.403 . . . . 3.3199999999999998 111.13 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 561' ' ' PHE . . . . . 0.617 ' HB2' HD21 ' A' ' 7' ' ' LEU . 2.6 t80 -74.94 -45.08 44.83 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 119.087 -1.045 . . . . 1.25 111.847 175.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . 0.633 ' HA ' HD12 ' B' ' 555' ' ' LEU . 2.1 tt -50.0 -59.11 4.2 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.466 0.306 . . . . 1.3200000000000001 110.29 175.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 563' ' ' LYS . . . . . 0.69 ' HG3' HE22 ' B' ' 603' ' ' GLN . 11.0 mmpt? -50.22 -38.67 41.48 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.863 1.061 . . . . 2.7400000000000002 113.863 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 564' ' ' THR . . . . . 0.426 HG23 ' O ' ' B' ' 560' ' ' LYS . 24.0 p -71.79 -39.33 69.98 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.495 0.664 . . . . 1.24 110.408 -176.107 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 565' ' ' VAL . . . . . 0.458 HG23 ' O ' ' B' ' 561' ' ' PHE . 97.9 t -62.83 -41.32 92.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.617 -0.72 . . . . 1.1899999999999999 112.502 173.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 566' ' ' VAL . . . . . 0.527 HG12 ' O ' ' B' ' 563' ' ' LYS . 11.5 p -71.06 -50.74 40.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 C-N-CA 120.451 -0.499 . . . . 1.3600000000000001 110.872 -176.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 567' ' ' ASN . . . . . 0.442 ' N ' HG13 ' B' ' 566' ' ' VAL . 6.7 t30 -51.13 -37.42 45.97 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.067 -0.515 . . . . 1.9399999999999999 112.006 170.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 568' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' B' ' 568' ' ' LYS . 0.3 OUTLIER -72.6 -32.7 66.17 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.746 -0.465 . . . . 3.5299999999999998 109.746 -179.234 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 569' ' ' LEU . . . . . 0.447 ' O ' ' HG3' ' B' ' 573' ' ' MET . 4.1 mp -67.43 -36.52 81.39 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.67 -0.863 . . . . 2.0099999999999998 108.67 177.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 570' ' ' PHE . . . . . 0.406 ' CE2' HG22 ' B' ' 566' ' ' VAL . 19.5 m-85 -65.38 -39.28 92.06 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.907 -0.405 . . . . 3.77 109.907 178.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.73 -53.47 57.79 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 119.921 -0.711 . . . . 2.4700000000000002 110.51 176.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 572' ' ' PHE . . . . . 0.444 ' CE2' HD23 ' A' ' 17' ' ' LEU . 34.3 m-85 -62.49 -9.92 10.11 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.056 1.132 . . . . 1.23 114.056 -177.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 573' ' ' MET . . . . . 0.878 ' HB3' HD11 ' B' ' 625' ' ' LEU . 67.7 mtt -76.42 -5.31 46.75 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.618 0.723 . . . . 2.1099999999999999 109.625 178.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 30.0 m-70 -109.42 -0.51 18.91 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.842 -1.072 . . . . 3.2000000000000002 111.502 173.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 575' ' ' GLU . . . . . 0.42 ' HG2' HG11 ' B' ' 580' ' ' VAL . 13.0 tp10 -68.55 130.26 42.35 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.15 -0.477 . . . . 1.55 110.137 177.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 81.8 p -87.89 -21.27 25.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 112.981 0.734 . . . . 1.3999999999999999 112.981 -177.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -60.2 128.01 34.67 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.411 0.624 . . . . 2.8500000000000001 112.578 -175.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -44.9 125.88 5.4 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.388 -0.824 . . . . 2.1499999999999999 113.103 -171.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.22 -34.64 4.82 Favored Glycine 0 C--O 1.223 -0.553 0 N-CA-C 116.242 1.257 . . . . 0.0 116.242 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 580' ' ' VAL . . . . . 0.42 HG11 ' HG2' ' B' ' 575' ' ' GLU . 93.9 t -53.81 -46.27 63.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.232 0.827 . . . . 1.29 113.232 -175.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -59.77 -42.18 92.76 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.361 0.504 . . . . 1.99 112.361 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -60.56 -42.39 96.5 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.209 0.448 . . . . 2.23 112.209 172.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 26.4 mmt -60.76 -49.46 77.42 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 121.043 -0.263 . . . . 2.5800000000000001 110.402 175.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.92 80.2 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.265 -0.425 . . . . 0.029999999999999999 111.783 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 585' ' ' CYS . . . . . 0.417 ' O ' HG13 ' B' ' 589' ' ' ILE . 28.8 p -74.39 -40.98 61.7 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 120.066 -0.654 . . . . 1.5 111.929 -177.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -59.56 -46.35 89.16 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.209 -0.45 . . . . 1.98 111.962 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 587' ' ' THR . . . . . 0.818 HG21 ' HB3' ' B' ' 545' ' ' MET . 29.3 p -62.19 -41.23 98.14 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.298 0.639 . . . . 1.3 110.42 175.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -61.4 -32.25 72.18 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.059 -0.519 . . . . 0.53000000000000003 111.177 -177.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 589' ' ' ILE . . . . . 0.417 HG13 ' O ' ' B' ' 585' ' ' CYS . 74.4 mt -79.81 -35.97 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 C-N-CA 116.91 -1.916 . . . . 1.97 109.831 -175.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -57.48 -49.99 74.49 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 107.717 -1.216 . . . . 2.6200000000000001 107.717 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . 0.42 HG12 ' O ' ' B' ' 587' ' ' THR . 49.0 mm -63.86 -43.71 97.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.697 -0.683 . . . . 1.96 112.779 -176.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.96 -39.13 93.44 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.512 -0.475 . . . . 0.0 112.252 177.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -62.34 -70.12 0.22 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 119.129 -1.029 . . . . 2.3599999999999999 109.825 174.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -56.19 -23.65 36.62 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 116.617 2.08 . . . . 2.1899999999999999 116.617 -176.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.4 p -121.79 25.29 9.29 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.189 1.181 . . . . 1.26 114.189 -178.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -48.54 -38.58 20.84 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 115.841 1.793 . . . . 3.5800000000000001 115.841 -172.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . 0.427 ' O ' HG22 ' B' ' 600' ' ' VAL . 96.8 mtt180 -69.47 -32.64 71.68 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.302 0.852 . . . . 3.7400000000000002 113.302 -175.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -70.19 -3.78 18.48 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.523 -0.762 . . . . 2.1400000000000001 112.032 -173.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -105.6 -16.87 14.58 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.633 0.583 . . . . 2.9500000000000002 110.197 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . 0.427 HG22 ' O ' ' B' ' 597' ' ' ARG . 33.2 m -105.82 -24.39 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.037 -0.983 . . . . 1.4199999999999999 111.327 -175.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 601' ' ' GLN . . . . . 0.417 ' HG2' HG23 ' B' ' 600' ' ' VAL . 14.2 mm100 -101.98 139.49 37.54 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.535 -0.866 . . . . 2.3399999999999999 111.635 176.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 43.9 t -60.87 122.76 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 108.561 -0.903 . . . . 1.3700000000000001 108.561 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 603' ' ' GLN . . . . . 0.69 HE22 ' HG3' ' B' ' 563' ' ' LYS . 11.5 pt20 -92.8 167.33 11.93 Favored 'General case' 0 C--O 1.224 -0.263 0 O-C-N 123.673 0.608 . . . . 2.6800000000000002 110.116 -177.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 15.6 m -72.0 128.97 35.51 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 N-CA-C 112.98 0.733 . . . . 1.27 112.98 -175.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.33 6.57 64.43 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.11 -175.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 606' ' ' GLU . . . . . 0.572 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.3 tp10 -131.48 158.06 41.88 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.641 -0.824 . . . . 2.5099999999999998 110.757 175.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 5.3 t -103.32 -22.58 4.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.036 -0.984 . . . . 1.3999999999999999 112.472 -175.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 608' ' ' MET . . . . . 0.572 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 20.0 ptm -136.97 142.1 37.22 Favored Pre-proline 0 C--O 1.223 -0.297 0 N-CA-C 112.712 0.634 . . . . 2.6800000000000002 112.712 -174.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 609' ' ' PRO . . . . . 0.536 ' HB2' HG22 ' B' ' 611' ' ' ILE . 9.6 Cg_endo -51.91 130.8 35.92 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 120.902 1.068 . . . . 0.42999999999999999 112.202 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -57.0 -31.74 65.39 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.794 0.294 . . . . 2.3700000000000001 111.794 -174.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 611' ' ' ILE . . . . . 0.536 HG22 ' HB2' ' B' ' 609' ' ' PRO . 12.2 tt -50.16 -44.74 23.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 CA-C-O 120.782 0.325 . . . . 1.8400000000000001 110.493 178.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 612' ' ' ASP . . . . . 0.415 ' OD1' ' HG2' ' B' ' 609' ' ' PRO . 1.0 OUTLIER -50.04 -51.99 37.91 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.587 0.755 . . . . 2.1499999999999999 112.849 177.72 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -59.88 -37.1 78.41 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.604 -0.438 . . . . 2.6600000000000001 110.21 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 614' ' ' ILE . . . . . 0.439 ' O ' ' ND2' ' B' ' 617' ' ' ASN . 67.5 mt -64.6 -47.93 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 120.233 -0.587 . . . . 1.76 111.963 178.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 51.7 tp -62.66 -31.19 72.01 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.946 0.721 . . . . 1.8400000000000001 112.946 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -79.47 2.12 23.14 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.632 1.345 . . . . 2.0600000000000001 114.632 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 617' ' ' ASN . . . . . 0.46 ' ND2' ' C ' ' B' ' 617' ' ' ASN . 0.0 OUTLIER -142.47 15.79 2.01 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 113.141 0.793 . . . . 1.97 113.141 -174.248 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 618' ' ' ILE . . . . . 0.489 HG13 ' N ' ' B' ' 619' ' ' ASN . 19.7 pt -46.99 -47.06 8.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 C-N-CA 118.949 -1.1 . . . . 2.0099999999999998 110.139 -176.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 619' ' ' ASN . . . . . 0.489 ' N ' HG13 ' B' ' 618' ' ' ILE . 3.3 p-10 -63.21 -51.05 67.85 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.769 1.026 . . . . 2.2799999999999998 113.769 -176.355 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 620' ' ' THR . . . . . 0.411 HG23 ' ND2' ' B' ' 619' ' ' ASN . 62.9 p -56.89 -31.86 65.29 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 119.539 -0.864 . . . . 1.3200000000000001 110.774 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 621' ' ' ILE . . . . . 0.475 HG13 HG23 ' B' ' 622' ' ' ILE . 49.2 pt -79.36 -42.6 23.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 115.385 1.624 . . . . 2.0 115.385 -179.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 622' ' ' ILE . . . . . 0.72 ' HA ' HD13 ' B' ' 625' ' ' LEU . 43.5 pt -87.74 -6.24 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 115.005 1.483 . . . . 2.0899999999999999 115.005 -177.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 66.8 m -19.91 -58.38 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.543 2.053 . . . . 1.47 116.543 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -99.27 -7.63 26.13 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.983 -1.462 . . . . 2.0699999999999998 111.022 -163.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 625' ' ' LEU . . . . . 0.878 HD11 ' HB3' ' B' ' 573' ' ' MET . 8.8 mp -71.84 146.93 47.64 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 123.289 0.368 . . . . 1.6699999999999999 111.687 -173.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 626' ' ' GLN . . . . . 0.531 ' HB3' ' HD2' ' B' ' 627' ' ' PRO . 49.2 mt-30 -76.84 162.1 71.47 Favored Pre-proline 0 CA--C 1.518 -0.262 0 N-CA-C 108.818 -0.808 . . . . 2.3500000000000001 108.818 174.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 627' ' ' PRO . . . . . 0.531 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 6.1 Cg_endo -47.84 -43.62 28.91 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.813 1.428 . . . . 0.44 115.813 -178.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 628' ' ' GLN . . . . . 0.579 ' NE2' ' H ' ' B' ' 628' ' ' GLN . 2.1 mp0 -67.28 -43.03 82.78 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.396 -0.522 . . . . 2.6200000000000001 109.602 -174.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -63.25 -38.3 90.61 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.968 -0.56 . . . . 2.0600000000000001 110.92 178.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 630' ' ' VAL . . . . . 0.425 HG23 ' O ' ' B' ' 626' ' ' GLN . 93.5 t . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.22 -0.895 . . . . 1.3 110.644 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 112.399 -0.28 . . . . 9.8599999999999994 112.399 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.5 p -91.95 128.06 37.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.698 0.285 . . . . 8.7799999999999994 111.028 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -161.15 86.93 0.7 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 6.8200000000000003 111.051 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.8 p -91.52 11.33 24.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 6.25 111.131 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 153.2 62.71 0.01 OUTLIER Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.736 -0.745 . . . . 4.1200000000000001 112.502 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -114.68 -9.94 12.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.965 0.412 . . . . 4.0300000000000002 110.78 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.581 HD12 HD12 ' A' ' 10' ' ' LEU . 1.9 tp -71.38 -17.68 62.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.02 -0.536 . . . . 2.21 110.874 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -66.38 -32.91 74.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.132 -0.486 . . . . 3.79 111.337 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -79.88 -18.7 50.02 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.303 -0.408 . . . . 4.1699999999999999 111.245 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.581 HD12 HD12 ' A' ' 7' ' ' LEU . 20.8 mt -76.35 -35.84 58.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 2.5800000000000001 110.912 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.72 -40.53 69.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.091 -0.504 . . . . 2.8399999999999999 111.559 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 65.0 tp -62.86 -21.58 66.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.312 -0.404 . . . . 3.6699999999999999 111.16 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -79.31 -26.69 42.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.43 . . . . 4.9299999999999997 111.109 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.436 HD11 ' HD3' ' B' ' 568' ' ' LYS . 60.5 tp -64.4 -18.42 64.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.392 -0.367 . . . . 3.27 111.054 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.7 -27.74 63.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.244 -0.435 . . . . 3.1299999999999999 111.28 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -85.41 88.39 1.58 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.699 -0.762 . . . . 2.4700000000000002 112.576 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -159.81 94.75 1.15 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.855 0.36 . . . . 2.1400000000000001 110.506 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -130.62 140.89 50.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.063 -0.517 . . . . 3.9199999999999999 110.816 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.438 HD13 ' HA ' ' B' ' 538' ' ' ALA . 17.3 mt -134.88 68.67 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.337 -0.392 . . . . 3.25 110.802 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -134.23 146.99 50.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.154 -0.476 . . . . 5.9500000000000002 110.989 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -151.36 88.37 1.43 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.98 -0.555 . . . . 9.3900000000000006 110.248 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.7 p 53.99 -176.25 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.064 -0.516 . . . . 8.9700000000000006 111.364 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 36.86 69.23 0.22 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.064 -0.516 . . . . 11.67 111.727 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -105.2 -78.34 1.2 Allowed Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.792 -0.718 . . . . 12.859999999999999 112.553 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -75.4 -6.05 48.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.801 0.334 . . . . 15.369999999999999 110.867 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -96.74 -59.87 1.72 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.161 -0.472 . . . . 16.539999999999999 110.877 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.5 t . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.276 -0.869 . . . . 17.93 111.075 -179.889 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 504' ' ' ILE . . . . . 0.494 ' N ' HD13 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.291 0 N-CA-C 113.112 0.782 . . . . 2.1299999999999999 113.112 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 77.9 p -48.89 119.2 3.02 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.548 0.573 . . . . 1.29 112.548 174.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.78 1.51 67.89 Favored Glycine 0 CA--C 1.526 0.741 0 C-N-CA 120.948 -0.644 . . . . 0.0 114.468 -179.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.52 41.51 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.653 0.727 . . . . 0.02 112.456 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -112.5 160.02 18.2 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 121.196 0.522 . . . . 2.21 112.214 174.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -69.78 134.19 48.29 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.056 -0.72 . . . . 2.6699999999999999 109.056 174.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 510' ' ' GLU . . . . . 0.485 ' O ' ' HG3' ' B' ' 514' ' ' LYS . 38.7 mt-10 -41.62 -35.33 0.73 Allowed 'General case' 0 C--O 1.24 0.565 0 N-CA-C 113.498 0.925 . . . . 2.6600000000000001 113.498 -173.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -73.87 -41.94 61.49 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.485 -0.78 . . . . 2.4399999999999999 112.086 -176.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -64.93 -40.03 94.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.133 0.492 . . . . 2.0800000000000001 110.862 171.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . 0.438 ' O ' HD23 ' B' ' 517' ' ' LEU . 43.6 mt-10 -53.77 -48.55 69.65 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.344 -0.843 . . . . 1.9199999999999999 111.155 177.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 514' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' B' ' 510' ' ' GLU . 67.1 mttm -54.92 -57.62 10.92 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 116.476 -0.329 . . . . 2.73 111.852 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . 0.494 ' O ' HG22 ' B' ' 518' ' ' VAL . 5.8 tmm_? -56.59 -35.97 68.84 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.173 0.921 . . . . 3.75 111.086 -177.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -76.06 -45.59 33.42 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.118 -0.947 . . . . 1.8899999999999999 110.535 -173.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 517' ' ' LEU . . . . . 0.618 ' O ' HG22 ' B' ' 521' ' ' ILE . 4.5 mm? -66.75 -32.23 73.39 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.742 -0.663 . . . . 1.8999999999999999 112.627 177.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 518' ' ' VAL . . . . . 0.494 HG22 ' O ' ' B' ' 515' ' ' ARG . 35.9 m -67.48 -35.17 72.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 118.535 -1.266 . . . . 1.3999999999999999 109.034 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 42.2 m -72.89 -36.42 67.33 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.428 0.633 . . . . 1.1799999999999999 112.42 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 520' ' ' VAL . . . . . 0.57 HG12 ' HA ' ' B' ' 517' ' ' LEU . 7.1 p -71.19 -42.32 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 O-C-N 122.115 -0.366 . . . . 1.22 111.663 -174.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 521' ' ' ILE . . . . . 0.618 HG22 ' O ' ' B' ' 517' ' ' LEU . 14.3 tt -90.71 -25.7 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.473 1.657 . . . . 1.98 115.473 -175.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 6.1 tmmm? -60.86 -35.24 76.09 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.666 -0.864 . . . . 2.5699999999999998 108.666 173.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -92.41 -21.54 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.008 1.484 . . . . 2.1699999999999999 115.008 -177.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 80.5 mt -70.52 -45.44 65.56 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.315 -0.624 . . . . 1.48 109.315 168.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 85.0 mt -52.23 -45.42 65.28 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-O 121.273 0.559 . . . . 1.95 110.971 169.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.56 -40.48 94.21 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 -178.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 66.3 mt -63.7 -36.08 82.67 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.021 0.439 . . . . 1.6699999999999999 111.382 175.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 40.7 t -63.47 -47.74 80.55 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.104 -0.498 . . . . 0.58999999999999997 110.706 -175.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.7 -29.64 70.23 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.446 -0.797 . . . . 2.5 112.578 173.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -71.58 -54.76 9.43 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 113.384 0.883 . . . . 2.2400000000000002 113.384 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -68.75 137.87 54.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.937 -0.574 . . . . 2.2799999999999998 111.047 -177.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 532' ' ' ARG . . . . . 0.605 ' HD3' ' HZ1' ' B' ' 537' ' ' LYS . 21.7 tpp180 -96.42 160.73 14.25 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.798 -0.637 . . . . 4.21 110.166 178.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.62 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.854 -0.612 . . . . 0.0 114.022 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -47.08 -36.66 8.46 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.196 0.813 . . . . 2.9500000000000002 113.196 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -50.51 -51.86 43.75 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 120.367 -0.533 . . . . 2.2000000000000002 110.857 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 536' ' ' ASN . . . . . 0.499 ' O ' HG22 ' B' ' 539' ' ' ILE . 0.2 OUTLIER -66.13 -44.78 83.23 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.603 0.594 . . . . 1.47 112.603 178.359 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 537' ' ' LYS . . . . . 0.605 ' HZ1' ' HD3' ' B' ' 532' ' ' ARG . 62.6 mttp -67.87 -31.94 72.09 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.272 -174.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . 0.438 ' HA ' HD13 ' A' ' 19' ' ' ILE . . . -68.17 -46.96 69.29 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.886 -0.597 . . . . 0.040000000000000001 111.092 178.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 539' ' ' ILE . . . . . 0.499 HG22 ' O ' ' B' ' 536' ' ' ASN . 8.2 tp -58.22 -54.91 26.09 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 1.8200000000000001 111.247 173.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 540' ' ' ILE . . . . . 0.425 ' N ' HG23 ' B' ' 539' ' ' ILE . 48.4 mm -56.79 -48.06 81.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.607 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.51 -44.06 84.72 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 113.645 0.98 . . . . 0.02 113.645 179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 94.9 p -60.35 -38.88 85.22 Favored 'General case' 0 C--O 1.22 -0.478 0 C-N-CA 120.6 -0.44 . . . . 1.2 110.3 -178.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -68.95 -47.17 66.33 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 114.323 1.231 . . . . 2.0299999999999998 114.323 -175.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 544' ' ' ILE . . . . . 0.451 HG23 HG13 ' B' ' 521' ' ' ILE . 85.2 mt -52.55 -45.94 47.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.586 -0.894 . . . . 1.8100000000000001 108.586 169.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 545' ' ' MET . . . . . 0.453 ' HA ' HG12 ' B' ' 548' ' ' VAL . 74.2 mtm -64.03 -42.29 97.14 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.763 -0.775 . . . . 2.6000000000000001 112.818 179.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -58.34 -48.8 79.42 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 119.234 -0.986 . . . . 2.0800000000000001 109.838 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 95.0 mt -55.07 -61.41 1.06 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 112.846 0.684 . . . . 1.5 112.846 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 548' ' ' VAL . . . . . 0.633 HG23 HD21 ' B' ' 555' ' ' LEU . 10.5 p -47.36 -44.21 8.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.838 -0.745 . . . . 1.3999999999999999 111.442 176.213 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 549' ' ' GLY . . . . . 0.535 ' HA2' HD11 ' B' ' 591' ' ' ILE . . . -57.41 -28.08 58.9 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -87.01 -9.53 55.33 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 112.629 0.604 . . . . 2.27 112.629 -175.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 551' ' ' TYR . . . . . 0.543 ' O ' HD23 ' B' ' 555' ' ' LEU . 80.2 m-85 -120.46 59.66 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.796 1.035 . . . . 3.5299999999999998 113.796 -176.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 552' ' ' PRO . . . . . 0.549 ' HG3' ' HG2' ' B' ' 594' ' ' LYS . 13.3 Cg_endo -55.93 -39.43 91.19 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 O-C-N 122.087 0.52 . . . . 0.46000000000000002 113.114 177.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -56.26 -46.77 79.52 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 121.145 0.498 . . . . 3.8700000000000001 109.926 -174.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -48.98 -59.71 3.38 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 123.953 0.901 . . . . 0.69999999999999996 112.046 168.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 555' ' ' LEU . . . . . 0.633 HD21 HG23 ' B' ' 548' ' ' VAL . 4.3 mm? -54.3 -48.66 71.04 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 116.334 -0.394 . . . . 1.49 110.158 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . 0.571 ' HG3' ' HE2' ' B' ' 598' ' ' HIS . 21.3 ttm180 -53.87 -35.8 61.94 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.857 1.058 . . . . 3.0899999999999999 113.857 -178.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.1 -12.22 50.64 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.48 -0.488 . . . . 0.0 112.043 -177.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 33.8 m80 -128.19 78.47 1.84 Allowed 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.404 1.261 . . . . 2.9300000000000002 114.404 -177.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 47.1 p90 -50.47 -48.28 56.71 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 116.59 2.07 . . . . 3.1099999999999999 116.59 -176.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 560' ' ' LYS . . . . . 0.426 ' O ' HG23 ' B' ' 564' ' ' THR . 63.5 tttm -56.7 -36.61 69.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 3.3199999999999998 111.099 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 561' ' ' PHE . . . . . 0.449 ' O ' HG23 ' B' ' 565' ' ' VAL . 1.7 t80 -74.91 -45.15 44.61 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 119.163 -1.015 . . . . 1.25 111.847 175.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . 0.595 ' HA ' HD12 ' B' ' 555' ' ' LEU . 5.5 tt -49.96 -59.18 4.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.498 0.319 . . . . 1.3200000000000001 110.229 175.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 563' ' ' LYS . . . . . 0.466 ' HA ' HG22 ' B' ' 566' ' ' VAL . 39.7 tttm -50.2 -38.63 40.92 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.831 1.049 . . . . 2.7400000000000002 113.831 178.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 564' ' ' THR . . . . . 0.426 HG23 ' O ' ' B' ' 560' ' ' LYS . 23.3 p -71.81 -39.36 69.89 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.5 0.667 . . . . 1.24 110.366 -176.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 565' ' ' VAL . . . . . 0.449 HG23 ' O ' ' B' ' 561' ' ' PHE . 99.6 t -62.88 -41.28 92.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.628 -0.714 . . . . 1.1899999999999999 112.49 173.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 566' ' ' VAL . . . . . 0.717 ' HA ' HD23 ' B' ' 569' ' ' LEU . 30.3 m -71.01 -50.9 39.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 C-N-CA 120.485 -0.486 . . . . 1.3600000000000001 110.793 -176.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 567' ' ' ASN . . . . . 0.426 ' N ' HG23 ' B' ' 566' ' ' VAL . 15.3 m120 -51.07 -37.38 45.23 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 116.002 -0.545 . . . . 1.9399999999999999 112.007 170.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 568' ' ' LYS . . . . . 0.436 ' HD3' HD11 ' A' ' 14' ' ' LEU . 29.8 ttpt -72.64 -32.67 66.06 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.77 -0.456 . . . . 3.5299999999999998 109.77 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 569' ' ' LEU . . . . . 0.717 HD23 ' HA ' ' B' ' 566' ' ' VAL . 0.2 OUTLIER -67.5 -36.49 81.17 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 108.687 -0.857 . . . . 2.0099999999999998 108.687 177.058 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 570' ' ' PHE . . . . . 0.527 ' HD1' HG13 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.38 -39.27 92.05 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.907 -0.405 . . . . 3.77 109.907 178.346 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -57.74 -53.49 57.61 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.982 -0.687 . . . . 2.4700000000000002 110.47 176.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 572' ' ' PHE . . . . . 0.647 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 22.6 m-85 -62.45 -9.98 10.17 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.118 1.155 . . . . 1.23 114.118 -177.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 573' ' ' MET . . . . . 0.48 ' HB3' HD21 ' B' ' 625' ' ' LEU . 35.5 mtt -76.38 -5.26 46.44 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.641 0.734 . . . . 2.1099999999999999 109.651 178.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -109.44 -0.56 18.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.82 -1.082 . . . . 3.2000000000000002 111.411 173.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 575' ' ' GLU . . . . . 0.647 ' HG2' ' HA ' ' B' ' 572' ' ' PHE . 29.4 mm-40 -68.53 130.23 42.25 Favored 'General case' 0 C--O 1.233 0.221 0 O-C-N 123.422 0.451 . . . . 1.55 110.077 177.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 82.7 p -87.84 -21.36 25.07 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 113.011 0.745 . . . . 1.3999999999999999 113.011 -177.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -60.09 128.03 34.81 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.425 0.631 . . . . 2.8500000000000001 112.532 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -44.96 125.84 5.42 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.332 -0.849 . . . . 2.1499999999999999 113.119 -171.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.27 -34.69 4.8 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.219 1.247 . . . . 0.0 116.219 174.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 55.5 t -53.72 -46.42 62.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.13 0.789 . . . . 1.29 113.13 -175.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.584 ' HB3' HE22 ' B' ' 629' ' ' GLN . 66.3 mt-30 -59.57 -42.34 92.26 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.406 0.521 . . . . 1.99 112.406 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -60.53 -42.41 96.42 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 112.19 0.441 . . . . 2.23 112.19 172.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 6.9 tpt -60.7 -49.53 77.15 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 121.058 -0.257 . . . . 2.5800000000000001 110.416 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.79 -42.93 80.32 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.181 -0.463 . . . . 0.029999999999999999 111.692 -177.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 585' ' ' CYS . . . . . 0.423 ' O ' HG13 ' B' ' 589' ' ' ILE . 52.0 t -74.49 -40.87 61.55 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 119.976 -0.69 . . . . 1.5 111.91 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.54 -46.34 89.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.351 -0.386 . . . . 1.98 111.995 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 86.4 m -62.21 -41.22 98.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.3 110.381 175.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 588' ' ' PHE . . . . . 0.487 ' HB2' HD13 ' B' ' 569' ' ' LEU . 19.2 t80 -61.44 -32.23 72.2 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.089 -0.505 . . . . 0.53000000000000003 111.146 -177.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 589' ' ' ILE . . . . . 0.423 HG13 ' O ' ' B' ' 585' ' ' CYS . 68.8 mt -79.86 -35.99 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.008 0 C-N-CA 116.902 -1.919 . . . . 1.97 109.773 -175.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . 0.416 ' O ' ' HE3' ' B' ' 594' ' ' LYS . 67.8 mttm -57.47 -50.04 74.32 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 107.717 -1.216 . . . . 2.6200000000000001 107.717 176.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . 0.535 HD11 ' HA2' ' B' ' 549' ' ' GLY . 1.7 mp -63.77 -43.74 98.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.693 -0.685 . . . . 1.96 112.815 -177.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.95 -39.12 93.41 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.443 -0.503 . . . . 0.0 112.275 177.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -62.37 -70.02 0.22 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 119.096 -1.041 . . . . 2.3599999999999999 109.834 174.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 594' ' ' LYS . . . . . 0.549 ' HG2' ' HG3' ' B' ' 552' ' ' PRO . 0.0 OUTLIER -56.14 -23.8 36.91 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 116.655 2.095 . . . . 2.1899999999999999 116.655 -176.565 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 83.8 m -121.63 25.21 9.42 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.243 1.201 . . . . 1.26 114.243 -178.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -48.59 -38.49 20.9 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.792 1.775 . . . . 3.5800000000000001 115.792 -172.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . 0.425 ' O ' ' HG2' ' B' ' 601' ' ' GLN . 38.5 mmt180 -69.52 -32.69 71.69 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.202 0.816 . . . . 3.7400000000000002 113.202 -175.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 598' ' ' HIS . . . . . 0.571 ' HE2' ' HG3' ' B' ' 556' ' ' ARG . 31.3 m80 -70.13 -3.82 18.49 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.662 -0.699 . . . . 2.1400000000000001 112.053 -173.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 599' ' ' PHE . . . . . 0.544 ' O ' HG23 ' B' ' 611' ' ' ILE . 74.8 m-85 -105.52 -16.94 14.57 Favored 'General case' 0 CA--C 1.517 -0.295 0 O-C-N 123.669 0.606 . . . . 2.9500000000000002 110.279 -176.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 10.0 p -105.81 -24.36 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.031 -0.986 . . . . 1.4199999999999999 111.311 -175.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 601' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 30.3 pt20 -102.02 139.5 37.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.578 -0.849 . . . . 2.3399999999999999 111.569 176.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 6.6 m -60.91 122.71 12.1 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.441 0 N-CA-C 108.599 -0.889 . . . . 1.3700000000000001 108.599 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 603' ' ' GLN . . . . . 0.429 ' HB2' ' HE1' ' B' ' 610' ' ' PHE . 82.7 mm-40 -92.78 167.31 11.95 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 123.729 0.643 . . . . 2.6800000000000002 110.048 -177.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 62.1 t -71.98 128.99 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 113.018 0.748 . . . . 1.27 113.018 -175.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.4 6.5 64.38 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.881 -0.599 . . . . 0.0 112.039 -175.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -131.5 158.08 41.83 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.651 -0.82 . . . . 2.5099999999999998 110.788 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 607' ' ' VAL . . . . . 0.608 HG23 ' HG2' ' B' ' 608' ' ' MET . 19.0 m -103.29 -22.59 4.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.023 -0.989 . . . . 1.3999999999999999 112.447 -175.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 608' ' ' MET . . . . . 0.608 ' HG2' HG23 ' B' ' 607' ' ' VAL . 94.1 mmm -136.99 142.22 37.62 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 112.649 0.611 . . . . 2.6800000000000002 112.649 -174.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -52.07 130.84 36.65 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 120.899 1.066 . . . . 0.42999999999999999 112.165 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 610' ' ' PHE . . . . . 0.464 ' H ' ' HD1' ' B' ' 610' ' ' PHE . 7.8 m-85 -56.96 -31.8 65.39 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 111.874 0.324 . . . . 2.3700000000000001 111.874 -174.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 611' ' ' ILE . . . . . 0.544 HG23 ' O ' ' B' ' 599' ' ' PHE . 10.3 pt -50.07 -44.79 22.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-O 120.726 0.298 . . . . 1.8400000000000001 110.548 178.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 612' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -50.01 -52.02 37.3 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.597 0.759 . . . . 2.1499999999999999 112.821 177.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -59.96 -37.05 78.47 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.535 -0.466 . . . . 2.6600000000000001 110.234 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 614' ' ' ILE . . . . . 0.412 HD12 ' HA ' ' B' ' 611' ' ' ILE . 60.5 mt -64.44 -48.1 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 120.246 -0.582 . . . . 1.76 111.925 178.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 55.0 tp -62.61 -31.17 71.96 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.955 0.724 . . . . 1.8400000000000001 112.955 -177.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -79.5 2.12 23.23 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.621 1.341 . . . . 2.0600000000000001 114.621 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 617' ' ' ASN . . . . . 0.434 ' O ' HG22 ' B' ' 621' ' ' ILE . 38.8 m-80 -142.44 15.67 2.01 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.168 0.803 . . . . 1.97 113.168 -174.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 618' ' ' ILE . . . . . 0.466 HG13 ' N ' ' B' ' 619' ' ' ASN . 20.9 pt -46.92 -47.06 8.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 C-N-CA 118.957 -1.097 . . . . 2.0099999999999998 110.127 -176.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 619' ' ' ASN . . . . . 0.466 ' N ' HG13 ' B' ' 618' ' ' ILE . 18.8 m120 -63.2 -51.05 67.89 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.787 1.032 . . . . 2.2799999999999998 113.787 -176.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 42.0 m -56.92 -31.83 65.33 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 119.455 -0.898 . . . . 1.3200000000000001 110.763 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 621' ' ' ILE . . . . . 0.527 HG13 ' HD1' ' B' ' 570' ' ' PHE . 15.0 tt -79.35 -42.61 23.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 115.355 1.613 . . . . 2.0 115.355 -179.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 622' ' ' ILE . . . . . 0.452 HG23 HG23 ' B' ' 621' ' ' ILE . 38.3 pt -87.73 -6.24 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 115.09 1.515 . . . . 2.0899999999999999 115.09 -177.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.7 t -19.9 -58.39 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 116.598 2.073 . . . . 1.47 116.598 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -99.21 -7.56 26.33 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 113.981 -1.463 . . . . 2.0699999999999998 111.056 -164.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 625' ' ' LEU . . . . . 0.627 HD22 HE21 ' B' ' 629' ' ' GLN . 90.2 mt -71.9 146.91 47.54 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.264 0.352 . . . . 1.6699999999999999 111.654 -173.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 626' ' ' GLN . . . . . 0.451 ' O ' HG23 ' B' ' 630' ' ' VAL . 30.0 mm-40 -76.84 162.09 71.51 Favored Pre-proline 0 CA--C 1.519 -0.233 0 N-CA-C 108.773 -0.825 . . . . 2.3500000000000001 108.773 174.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -47.83 -43.61 28.88 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.813 1.428 . . . . 0.44 115.813 -178.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.25 -43.01 82.97 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 120.423 -0.511 . . . . 2.6200000000000001 109.686 -174.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 629' ' ' GLN . . . . . 0.627 HE21 HD22 ' B' ' 625' ' ' LEU . 25.2 mt-30 -63.35 -38.16 90.07 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.856 -0.611 . . . . 2.0600000000000001 110.904 178.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 630' ' ' VAL . . . . . 0.451 HG23 ' O ' ' B' ' 626' ' ' GLN . 67.2 t . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.33 -0.843 . . . . 1.3 110.687 176.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.187 0 N-CA-C 112.558 -0.217 . . . . 9.8599999999999994 112.558 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.8 t -151.91 79.65 1.26 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.84 0.352 . . . . 8.7799999999999994 110.749 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.78 -22.45 46.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 6.8200000000000003 111.126 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 84.2 p -149.94 -26.81 0.25 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.109 -0.496 . . . . 6.25 110.827 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 112.29 177.44 19.92 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.763 -0.732 . . . . 4.1200000000000001 112.657 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -139.58 -11.86 1.17 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.88 0.371 . . . . 4.0300000000000002 110.849 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.412 ' N ' HD12 ' A' ' 7' ' ' LEU . 7.7 mp -77.98 -9.29 59.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.057 -0.52 . . . . 2.21 110.975 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -60.73 -26.79 67.44 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.299 -0.41 . . . . 3.79 111.179 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -78.55 -47.65 16.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.264 -0.425 . . . . 4.1699999999999999 110.94 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.602 HD22 HG21 ' B' ' 518' ' ' VAL . 1.8 pp -73.94 -9.04 58.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 2.5800000000000001 111.068 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.49 -16.14 60.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.953 0.406 . . . . 2.8399999999999999 110.803 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 43.1 tp -70.84 -9.49 57.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.982 -0.554 . . . . 3.6699999999999999 110.764 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.404 ' HB3' ' CD2' ' B' ' 525' ' ' LEU . 14.2 mptt -66.37 -50.53 63.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.043 -0.526 . . . . 4.9299999999999997 111.997 -179.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.13 -8.59 46.8 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.625 0.25 . . . . 3.27 111.362 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -48.09 -20.89 0.39 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.079 0.4 . . . . 3.1299999999999999 112.079 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -152.32 136.34 5.38 Favored Glycine 0 C--N 1.332 0.359 0 C-N-CA 120.315 -0.945 . . . . 2.4700000000000002 113.195 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.492 HD11 ' SG ' ' B' ' 528' ' ' CYS . 22.0 tp -137.62 157.62 46.11 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 110.263 -0.273 . . . . 2.1400000000000001 110.263 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -117.04 105.43 12.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.769 0.319 . . . . 3.9199999999999999 111.023 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 6.4 tp -130.36 -33.5 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.193 -0.458 . . . . 3.25 110.947 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -81.33 -57.83 3.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.14 -0.482 . . . . 5.9500000000000002 111.157 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.473 ' HG2' HG23 ' A' ' 22' ' ' THR . 87.5 tttt -169.08 -55.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.227 -0.442 . . . . 9.3900000000000006 110.699 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.473 HG23 ' HG2' ' A' ' 21' ' ' LYS . 81.6 p -129.63 173.58 10.48 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.131 -0.486 . . . . 8.9700000000000006 110.998 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -96.11 -72.66 0.62 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.442 -0.345 . . . . 11.67 110.782 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 140.87 -115.82 1.07 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.743 -0.742 . . . . 12.859999999999999 112.595 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -139.98 142.45 36.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.774 0.321 . . . . 15.369999999999999 110.888 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -83.61 122.69 28.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.264 -0.425 . . . . 16.539999999999999 111.265 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.4 t . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.203 -0.903 . . . . 17.93 111.296 179.901 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 35.0 pt . . . . . 0 C--O 1.235 0.291 0 N-CA-C 113.06 0.763 . . . . 2.1299999999999999 113.06 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 42.3 t -49.01 119.21 3.06 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.545 0.572 . . . . 1.29 112.545 174.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.79 1.5 67.87 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.995 -0.621 . . . . 0.0 114.418 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.31 -7.53 41.59 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.711 0.755 . . . . 0.02 112.443 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 508' ' ' MET . . . . . 0.426 ' HB2' ' HG2' ' B' ' 513' ' ' GLU . 24.6 mmt -112.46 159.96 18.23 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 121.123 0.487 . . . . 2.21 112.297 174.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -69.78 134.19 48.29 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.119 -0.697 . . . . 2.6699999999999999 109.119 174.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -41.67 -35.4 0.76 Allowed 'General case' 0 C--O 1.24 0.567 0 N-CA-C 113.401 0.889 . . . . 2.6600000000000001 113.401 -173.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -73.74 -41.91 61.87 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.505 -0.771 . . . . 2.4399999999999999 112.17 -176.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -64.9 -40.18 94.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.16 0.505 . . . . 2.0800000000000001 110.831 171.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . 0.426 ' HG2' ' HB2' ' B' ' 508' ' ' MET . 43.2 mt-10 -53.61 -48.76 68.98 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.357 -0.838 . . . . 1.9199999999999999 111.084 177.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 514' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -54.76 -57.66 10.66 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 111.917 0.34 . . . . 2.73 111.917 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . 0.523 ' O ' HG12 ' B' ' 518' ' ' VAL . 39.5 ttm180 -56.6 -35.93 68.83 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.132 0.895 . . . . 3.75 111.086 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.48 ' O ' HG23 ' B' ' 520' ' ' VAL . 56.7 t80 -76.14 -45.6 32.8 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.104 -0.953 . . . . 1.8899999999999999 110.504 -173.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 517' ' ' LEU . . . . . 0.491 ' O ' HG12 ' B' ' 521' ' ' ILE . 93.6 mt -66.72 -32.1 73.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.685 -0.689 . . . . 1.8999999999999999 112.752 177.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 518' ' ' VAL . . . . . 0.602 HG21 HD22 ' A' ' 10' ' ' LEU . 12.6 p -67.6 -35.03 71.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 118.456 -1.297 . . . . 1.3999999999999999 109.075 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 40.6 p -73.01 -36.3 66.98 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.1799999999999999 112.391 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 520' ' ' VAL . . . . . 0.48 HG23 ' O ' ' B' ' 516' ' ' PHE . 51.1 t -71.29 -42.22 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 116.416 -0.356 . . . . 1.22 111.716 -174.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 521' ' ' ILE . . . . . 0.491 HG12 ' O ' ' B' ' 517' ' ' LEU . 18.6 pt -90.78 -25.68 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 115.391 1.626 . . . . 1.98 115.391 -175.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 26.6 ttpp -60.91 -35.12 75.86 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.681 -0.859 . . . . 2.5699999999999998 108.681 173.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -92.43 -21.52 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.991 1.478 . . . . 2.1699999999999999 114.991 -177.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 524' ' ' LEU . . . . . 0.55 ' HG ' HD11 ' B' ' 540' ' ' ILE . 4.6 mp -70.63 -45.43 65.21 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.28 -0.637 . . . . 1.48 109.28 169.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . 0.404 ' CD2' ' HB3' ' A' ' 13' ' ' LYS . 26.9 tp -52.15 -45.56 65.07 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.253 0.549 . . . . 1.95 110.953 169.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.43 -40.52 94.47 Favored Glycine 0 N--CA 1.445 -0.735 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -178.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . 0.581 HD12 HE21 ' B' ' 530' ' ' GLN . 39.6 tp -63.55 -36.12 82.73 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.035 0.445 . . . . 1.6699999999999999 111.402 175.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 528' ' ' CYS . . . . . 0.492 ' SG ' HD11 ' A' ' 17' ' ' LEU . 41.8 t -63.49 -47.81 80.22 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 116.065 -0.516 . . . . 0.58999999999999997 110.632 -175.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -61.73 -29.5 70.16 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.467 -0.788 . . . . 2.5 112.615 173.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 530' ' ' GLN . . . . . 0.581 HE21 HD12 ' B' ' 527' ' ' LEU . 10.3 tt0 -71.7 -54.76 9.27 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.336 0.865 . . . . 2.2400000000000002 113.336 -177.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.73 137.95 54.48 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.014 -0.539 . . . . 2.2799999999999998 111.099 -177.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 11.1 ptp180 -96.5 160.71 14.25 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.83 -0.623 . . . . 4.21 110.117 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.42 119.62 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.854 -0.612 . . . . 0.0 114.022 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -47.14 -36.58 8.64 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.207 0.817 . . . . 2.9500000000000002 113.207 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -50.59 -51.77 45.29 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 120.373 -0.531 . . . . 2.2000000000000002 110.846 174.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -66.14 -44.84 83.01 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.59 0.589 . . . . 1.47 112.59 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 537' ' ' LYS . . . . . 0.57 ' HA ' HG22 ' B' ' 540' ' ' ILE . 60.3 mttm -67.84 -32.0 72.22 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.263 -174.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.12 -46.91 69.58 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 115.832 -0.622 . . . . 0.040000000000000001 111.137 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 78.8 mt -58.25 -54.91 26.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-O 121.533 0.682 . . . . 1.8200000000000001 111.247 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 540' ' ' ILE . . . . . 0.57 HG22 ' HA ' ' B' ' 537' ' ' LYS . 10.6 tp -56.73 -48.16 81.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.601 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 541' ' ' ALA . . . . . 0.467 ' O ' HG22 ' B' ' 544' ' ' ILE . . . -57.47 -44.04 84.52 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.573 0.953 . . . . 0.02 113.573 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 542' ' ' SER . . . . . 0.565 ' O ' ' HG2' ' B' ' 545' ' ' MET . 94.7 p -60.47 -38.74 85.21 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.574 -0.45 . . . . 1.2 110.296 -178.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 543' ' ' ASN . . . . . 0.468 ' O ' HD13 ' B' ' 547' ' ' ILE . 75.9 m-20 -69.03 -47.14 66.16 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.316 1.228 . . . . 2.0299999999999998 114.316 -175.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 544' ' ' ILE . . . . . 0.467 HG22 ' O ' ' B' ' 541' ' ' ALA . 14.7 tt -52.64 -46.0 48.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.46 -0.941 . . . . 1.8100000000000001 108.46 170.061 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 545' ' ' MET . . . . . 0.565 ' HG2' ' O ' ' B' ' 542' ' ' SER . 0.0 OUTLIER -64.04 -42.31 97.1 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.688 -0.805 . . . . 2.6000000000000001 112.757 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -58.34 -48.76 79.52 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 119.213 -0.995 . . . . 2.0800000000000001 109.867 176.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 547' ' ' ILE . . . . . 0.468 HD13 ' O ' ' B' ' 543' ' ' ASN . 1.7 mp -55.09 -61.38 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.854 0.687 . . . . 1.5 112.854 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 548' ' ' VAL . . . . . 0.618 HG22 HD11 ' B' ' 555' ' ' LEU . 9.9 p -47.29 -44.32 8.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.843 -0.743 . . . . 1.3999999999999999 111.43 176.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.02 58.81 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.764 -0.585 . . . . 0.0 112.934 -177.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 550' ' ' GLN . . . . . 0.467 ' C ' ' HD3' ' B' ' 552' ' ' PRO . 32.5 tt0 -87.06 -9.52 55.24 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 112.617 0.599 . . . . 2.27 112.617 -175.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -120.44 59.64 7.08 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 113.823 1.046 . . . . 3.5299999999999998 113.823 -176.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 552' ' ' PRO . . . . . 0.586 ' HG2' ' HG2' ' B' ' 594' ' ' LYS . 44.2 Cg_exo -55.96 -39.4 91.41 Favored 'Trans proline' 0 C--O 1.222 -0.291 0 O-C-N 122.124 0.539 . . . . 0.46000000000000002 113.151 177.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 553' ' ' ARG . . . . . 0.488 ' HA ' ' HE ' ' B' ' 556' ' ' ARG . 98.9 mtt180 -56.27 -46.68 79.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.164 0.507 . . . . 3.8700000000000001 109.99 -174.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.04 -59.7 3.4 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 123.931 0.892 . . . . 0.69999999999999996 112.108 167.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 555' ' ' LEU . . . . . 0.621 ' HB3' HD13 ' B' ' 562' ' ' LEU . 87.0 mt -54.4 -48.51 71.48 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 116.322 -0.399 . . . . 1.49 110.177 -178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . 0.488 ' HE ' ' HA ' ' B' ' 553' ' ' ARG . 59.5 mtm180 -53.93 -35.87 62.16 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.827 1.047 . . . . 3.0899999999999999 113.827 -178.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.03 -12.26 50.73 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.528 -0.469 . . . . 0.0 112.078 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 558' ' ' HIS . . . . . 0.577 ' ND1' ' HB2' ' B' ' 561' ' ' PHE . 8.5 t-160 -128.22 78.48 1.84 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.405 1.261 . . . . 2.9300000000000002 114.405 -177.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 34.6 p90 -50.48 -48.29 56.8 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 116.526 2.047 . . . . 3.1099999999999999 116.526 -176.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 560' ' ' LYS . . . . . 0.418 ' O ' HG23 ' B' ' 564' ' ' THR . 5.0 tppp? -56.71 -36.55 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.303 -0.408 . . . . 3.3199999999999998 111.15 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 561' ' ' PHE . . . . . 0.577 ' HB2' ' ND1' ' B' ' 558' ' ' HIS . 9.0 t80 -74.96 -45.06 44.86 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 119.1 -1.04 . . . . 1.25 111.908 175.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . 0.621 HD13 ' HB3' ' B' ' 555' ' ' LEU . 62.3 tp -49.97 -59.22 4.09 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.515 0.326 . . . . 1.3200000000000001 110.255 175.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 563' ' ' LYS . . . . . 0.511 ' O ' HG12 ' B' ' 566' ' ' VAL . 39.7 ttmt -50.16 -38.66 40.54 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.893 1.071 . . . . 2.7400000000000002 113.893 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 564' ' ' THR . . . . . 0.418 HG23 ' O ' ' B' ' 560' ' ' LYS . 23.5 p -71.71 -39.42 70.17 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.572 0.701 . . . . 1.24 110.412 -176.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 565' ' ' VAL . . . . . 0.467 HG23 ' O ' ' B' ' 561' ' ' PHE . 85.1 t -62.84 -41.34 92.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.646 -0.706 . . . . 1.1899999999999999 112.527 173.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 566' ' ' VAL . . . . . 0.511 HG12 ' O ' ' B' ' 563' ' ' LYS . 13.1 p -70.96 -50.85 40.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.537 -0.465 . . . . 1.3600000000000001 110.875 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 567' ' ' ASN . . . . . 0.437 ' N ' HG13 ' B' ' 566' ' ' VAL . 2.8 t-20 -51.04 -37.47 45.55 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.009 -0.541 . . . . 1.9399999999999999 112.044 170.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 40.4 tptt -72.69 -32.63 65.93 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.716 -0.475 . . . . 3.5299999999999998 109.716 -179.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 569' ' ' LEU . . . . . 0.489 ' O ' ' HG3' ' B' ' 573' ' ' MET . 60.1 mt -67.5 -36.41 81.02 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 108.696 -0.853 . . . . 2.0099999999999998 108.696 177.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 570' ' ' PHE . . . . . 0.41 ' CE2' HG22 ' B' ' 566' ' ' VAL . 25.2 m-85 -65.35 -39.38 92.28 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.868 -0.419 . . . . 3.77 109.868 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -57.7 -53.51 57.38 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 119.985 -0.686 . . . . 2.4700000000000002 110.495 176.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 572' ' ' PHE . . . . . 0.631 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 18.6 m-85 -62.44 -9.86 9.79 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.093 1.146 . . . . 1.23 114.093 -177.189 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 573' ' ' MET . . . . . 0.906 ' HB3' HD11 ' B' ' 625' ' ' LEU . 67.9 mtt -76.47 -5.26 46.7 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.637 0.732 . . . . 2.1099999999999999 109.662 178.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -109.49 -0.57 18.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.765 -1.107 . . . . 3.2000000000000002 111.492 173.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 575' ' ' GLU . . . . . 0.631 ' HG2' ' HA ' ' B' ' 572' ' ' PHE . 25.2 mm-40 -68.47 130.15 42.01 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.169 -0.469 . . . . 1.55 110.214 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 76.8 p -87.79 -21.41 25.12 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.941 0.719 . . . . 1.3999999999999999 112.941 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -60.1 128.05 34.9 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.418 0.627 . . . . 2.8500000000000001 112.584 -175.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -44.95 125.88 5.44 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.372 -0.831 . . . . 2.1499999999999999 113.103 -171.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 579' ' ' GLY . . . . . 0.415 ' O ' ' HG2' ' B' ' 583' ' ' MET . . . 96.23 -34.74 4.76 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.195 1.238 . . . . 0.0 116.195 174.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 47.1 t -53.77 -46.22 62.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.173 0.805 . . . . 1.29 113.173 -175.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -59.75 -42.27 92.87 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.333 0.494 . . . . 1.99 112.333 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -60.53 -42.46 96.55 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 112.202 0.445 . . . . 2.23 112.202 172.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 583' ' ' MET . . . . . 0.556 ' HB3' ' SD ' ' B' ' 545' ' ' MET . 28.6 mmt -60.66 -49.47 77.37 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.99 -0.284 . . . . 2.5800000000000001 110.475 175.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.76 -42.97 80.32 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.197 -0.456 . . . . 0.029999999999999999 111.722 -177.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 77.5 m -74.32 -41.02 61.82 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 120.078 -0.649 . . . . 1.5 111.949 -177.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 586' ' ' ASP . . . . . 0.651 ' O ' HG22 ' B' ' 589' ' ' ILE . 69.2 m-20 -59.56 -46.3 89.3 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 116.252 -0.431 . . . . 1.98 111.984 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 587' ' ' THR . . . . . 0.413 ' OG1' ' HG3' ' B' ' 545' ' ' MET . 73.7 m -62.19 -41.22 98.14 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.3 110.43 175.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -61.45 -32.23 72.2 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.085 -0.507 . . . . 0.53000000000000003 111.177 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 589' ' ' ILE . . . . . 0.651 HG22 ' O ' ' B' ' 586' ' ' ASP . 10.0 tp -79.88 -35.95 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.835 -1.946 . . . . 1.97 109.74 -175.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . 0.429 ' O ' ' HE3' ' B' ' 594' ' ' LYS . 67.1 mttm -57.51 -50.02 74.44 Favored 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 107.697 -1.223 . . . . 2.6200000000000001 107.697 176.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 74.6 mt -63.76 -43.85 98.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 123.345 0.658 . . . . 1.96 112.77 -177.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.08 93.37 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.417 -0.513 . . . . 0.0 112.331 177.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -62.35 -70.14 0.22 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 119.12 -1.032 . . . . 2.3599999999999999 109.783 174.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 594' ' ' LYS . . . . . 0.586 ' HG2' ' HG2' ' B' ' 552' ' ' PRO . 0.0 OUTLIER -56.02 -23.79 35.27 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 116.69 2.107 . . . . 2.1899999999999999 116.69 -176.564 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 74.3 m -121.74 25.26 9.34 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.249 1.203 . . . . 1.26 114.249 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 596' ' ' ARG . . . . . 0.521 ' HG3' ' HD3' ' B' ' 597' ' ' ARG . 24.3 ptt180 -48.48 -38.54 20.32 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.856 1.799 . . . . 3.5800000000000001 115.856 -172.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . 0.521 ' HD3' ' HG3' ' B' ' 596' ' ' ARG . 0.5 OUTLIER -69.66 -32.53 71.24 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.225 0.824 . . . . 3.7400000000000002 113.225 -175.512 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 51.8 m-70 -70.09 -3.86 18.54 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-N 115.581 -0.736 . . . . 2.1400000000000001 112.054 -173.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -105.55 -16.93 14.57 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.613 0.571 . . . . 2.9500000000000002 110.18 -176.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . 0.414 HG22 ' O ' ' B' ' 597' ' ' ARG . 33.8 m -105.82 -24.41 4.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 CA-C-N 115.114 -0.948 . . . . 1.4199999999999999 111.242 -175.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 601' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 3.5 pt20 -101.95 139.49 37.51 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.56 -0.856 . . . . 2.3399999999999999 111.635 176.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 48.9 t -60.89 122.66 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 108.596 -0.89 . . . . 1.3700000000000001 108.596 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -92.67 167.3 11.99 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.649 0.593 . . . . 2.6800000000000002 110.138 -177.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 40.5 t -71.99 129.03 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 119.87 -0.732 . . . . 1.27 112.968 -175.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.31 6.6 64.45 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.096 -175.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 606' ' ' GLU . . . . . 0.505 ' HG3' ' H ' ' B' ' 608' ' ' MET . 10.5 tp10 -131.46 157.98 42.05 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.667 -0.813 . . . . 2.5099999999999998 110.841 175.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 33.9 m -103.24 -22.53 4.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.063 -0.972 . . . . 1.3999999999999999 112.507 -175.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 608' ' ' MET . . . . . 0.505 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 52.6 ttm -136.97 142.18 37.5 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.651 0.611 . . . . 2.6800000000000002 112.651 -174.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 609' ' ' PRO . . . . . 0.499 ' HD2' ' HG3' ' B' ' 608' ' ' MET . 54.2 Cg_exo -52.11 130.96 37.28 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.89 1.06 . . . . 0.42999999999999999 112.086 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -57.03 -31.86 65.58 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 123.183 0.302 . . . . 2.3700000000000001 111.799 -174.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 611' ' ' ILE . . . . . 0.42 HG23 ' N ' ' B' ' 612' ' ' ASP . 13.4 tt -49.92 -44.97 21.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 120.816 0.341 . . . . 1.8400000000000001 110.538 178.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 612' ' ' ASP . . . . . 0.42 ' N ' HG23 ' B' ' 611' ' ' ILE . 15.0 m-20 -49.86 -52.0 36.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.612 0.765 . . . . 2.1499999999999999 112.875 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.02 -37.06 78.64 Favored 'General case' 0 C--O 1.244 0.802 0 C-N-CA 120.555 -0.458 . . . . 2.6600000000000001 110.183 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 72.6 mt -64.53 -47.93 87.1 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 120.214 -0.594 . . . . 1.76 112.002 178.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 93.3 mt -62.67 -31.17 72.0 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.955 0.724 . . . . 1.8400000000000001 112.955 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -79.5 2.12 23.23 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.621 1.341 . . . . 2.0600000000000001 114.621 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 617' ' ' ASN . . . . . 0.574 ' HB2' HG22 ' B' ' 620' ' ' THR . 26.2 p30 -142.44 15.62 2.01 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.168 0.803 . . . . 1.97 113.168 -174.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 618' ' ' ILE . . . . . 0.496 HG13 ' N ' ' B' ' 619' ' ' ASN . 16.7 pt -46.9 -47.02 8.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.0099999999999998 110.222 -176.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 619' ' ' ASN . . . . . 0.496 ' N ' HG13 ' B' ' 618' ' ' ILE . 7.3 t30 -63.12 -51.21 67.44 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 113.777 1.028 . . . . 2.2799999999999998 113.777 -176.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 620' ' ' THR . . . . . 0.574 HG22 ' HB2' ' B' ' 617' ' ' ASN . 4.1 t -56.82 -31.87 65.16 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 119.445 -0.902 . . . . 1.3200000000000001 110.785 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 621' ' ' ILE . . . . . 0.521 HG13 HG23 ' B' ' 622' ' ' ILE . 36.1 pt -79.26 -42.73 23.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 N-CA-C 115.342 1.608 . . . . 2.0 115.342 -179.036 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 622' ' ' ILE . . . . . 0.737 ' HA ' HD13 ' B' ' 625' ' ' LEU . 39.5 pt -87.67 -6.32 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 115.031 1.493 . . . . 2.0899999999999999 115.031 -177.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.3 t -19.9 -58.33 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 116.642 2.09 . . . . 1.47 116.642 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -99.35 -7.53 26.11 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.028 -1.442 . . . . 2.0699999999999998 110.973 -163.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 625' ' ' LEU . . . . . 0.906 HD11 ' HB3' ' B' ' 573' ' ' MET . 9.5 mp -71.81 146.85 47.75 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.493 -0.321 . . . . 1.6699999999999999 111.748 -173.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 626' ' ' GLN . . . . . 0.455 HE21 HE22 ' B' ' 629' ' ' GLN . 24.8 mt-30 -76.73 162.09 71.69 Favored Pre-proline 0 N--CA 1.464 0.237 0 N-CA-C 108.843 -0.799 . . . . 2.3500000000000001 108.843 174.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -47.81 -43.6 28.82 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.823 1.432 . . . . 0.44 115.823 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 628' ' ' GLN . . . . . 0.612 HE21 ' HA ' ' B' ' 628' ' ' GLN . 0.0 OUTLIER -67.33 -43.0 82.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.427 -0.509 . . . . 2.6200000000000001 109.631 -174.621 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 629' ' ' GLN . . . . . 0.455 HE22 HE21 ' B' ' 626' ' ' GLN . 1.7 mp0 -63.31 -38.2 90.22 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.924 -0.58 . . . . 2.0600000000000001 110.924 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 630' ' ' VAL . . . . . 0.422 HG23 ' O ' ' B' ' 626' ' ' GLN . 90.7 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.195 -0.907 . . . . 1.3 110.615 176.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.18 0 N-CA-C 112.399 -0.28 . . . . 9.8599999999999994 112.399 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.1 m -91.47 138.23 31.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.784 0.326 . . . . 8.7799999999999994 110.807 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.53 -176.83 0.12 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.08 -0.509 . . . . 6.8200000000000003 111.267 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.2 m -153.54 25.9 0.51 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.992 -0.549 . . . . 6.25 110.732 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 167.95 159.22 13.13 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.784 -0.722 . . . . 4.1200000000000001 112.348 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -141.63 -22.8 0.73 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.728 0.299 . . . . 4.0300000000000002 111.004 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.539 HD12 HD22 ' A' ' 10' ' ' LEU . 20.3 tp -76.18 -18.22 59.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.284 -0.417 . . . . 2.21 110.905 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -76.74 -50.28 13.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.919 0.39 . . . . 3.79 110.801 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -76.13 -9.85 58.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.098 -0.501 . . . . 4.1699999999999999 110.351 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.539 HD22 HD12 ' A' ' 7' ' ' LEU . 13.5 tp -62.95 -38.32 90.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.695 -0.684 . . . . 2.5800000000000001 111.022 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.07 -10.33 59.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.138 -0.483 . . . . 2.8399999999999999 111.519 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 24.9 tp -60.62 -22.91 64.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.345 -0.388 . . . . 3.6699999999999999 110.943 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -80.39 -21.65 42.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.248 -0.433 . . . . 4.9299999999999997 111.71 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.663 HD13 ' O ' ' A' ' 14' ' ' LEU . 2.2 tm? -51.96 -29.4 20.33 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.885 0.374 . . . . 3.27 110.505 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.24 -17.93 0.3 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.012 -0.54 . . . . 3.1299999999999999 111.949 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -84.02 -122.78 0.96 Allowed Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.83 -0.7 . . . . 2.4700000000000002 112.44 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.447 HD23 HD12 ' B' ' 525' ' ' LEU . 0.3 OUTLIER 55.54 83.41 0.09 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.773 0.32 . . . . 2.1400000000000001 110.716 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -95.73 153.31 17.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 3.9199999999999999 110.924 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 18.1 tt -171.78 -18.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 3.25 110.887 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -65.56 94.63 0.19 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.214 -0.448 . . . . 5.9500000000000002 110.763 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.8 ptmm? -165.38 137.83 4.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.404 -0.362 . . . . 9.3900000000000006 111.136 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.0 p -116.63 -49.14 2.66 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.119 -0.491 . . . . 8.9700000000000006 111.015 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 57.59 90.17 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.17 -0.468 . . . . 11.67 111.05 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 158.18 -93.71 0.13 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.873 -0.68 . . . . 12.859999999999999 112.425 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 54.75 77.48 0.2 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.794 0.33 . . . . 15.369999999999999 111.027 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -132.17 28.75 4.4 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.179 -0.464 . . . . 16.539999999999999 110.868 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 52.1 t . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.191 -0.909 . . . . 17.93 111.081 -179.954 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 504' ' ' ILE . . . . . 0.432 ' N ' HD13 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.235 0.339 0 N-CA-C 113.069 0.766 . . . . 2.1299999999999999 113.069 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 79.2 p -48.83 119.13 2.95 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.542 0.571 . . . . 1.29 112.542 174.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.82 1.43 67.85 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 120.926 -0.654 . . . . 0.0 114.477 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.34 -7.53 41.5 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.627 0.714 . . . . 0.02 112.443 176.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 63.2 mtt -112.47 159.99 18.22 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.11 0.481 . . . . 2.21 112.221 174.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -69.79 134.25 48.34 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.061 -0.718 . . . . 2.6699999999999999 109.061 174.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -41.62 -35.48 0.76 Allowed 'General case' 0 C--O 1.241 0.623 0 N-CA-C 113.39 0.885 . . . . 2.6600000000000001 113.39 -173.283 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -73.8 -41.92 61.69 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.541 -0.754 . . . . 2.4399999999999999 112.087 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -64.88 -40.1 94.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.111 0.482 . . . . 2.0800000000000001 110.863 171.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -53.64 -48.71 69.12 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.38 -0.827 . . . . 1.9199999999999999 111.141 177.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 514' ' ' LYS . . . . . 0.541 ' O ' HG13 ' B' ' 518' ' ' VAL . 39.0 ttmt -54.88 -57.56 11.11 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 111.93 0.345 . . . . 2.73 111.93 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . 0.523 ' O ' HG22 ' B' ' 518' ' ' VAL . 28.2 mmm180 -56.62 -35.94 68.89 Favored 'General case' 0 CA--C 1.505 -0.759 0 O-C-N 124.221 0.951 . . . . 3.75 111.124 -177.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.718 ' O ' HG13 ' B' ' 520' ' ' VAL . 70.8 t80 -76.08 -45.58 33.34 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.101 -0.954 . . . . 1.8899999999999999 110.515 -173.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 517' ' ' LEU . . . . . 0.748 ' HA ' HG22 ' B' ' 520' ' ' VAL . 3.1 tt -66.76 -32.24 73.41 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.755 -0.657 . . . . 1.8999999999999999 112.606 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 518' ' ' VAL . . . . . 0.541 HG13 ' O ' ' B' ' 514' ' ' LYS . 34.2 m -67.53 -35.07 72.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 C-N-CA 118.473 -1.291 . . . . 1.3999999999999999 109.087 178.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 47.8 m -72.96 -36.35 67.13 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.295 0.569 . . . . 1.1799999999999999 112.437 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 520' ' ' VAL . . . . . 0.748 HG22 ' HA ' ' B' ' 517' ' ' LEU . 22.0 m -71.23 -42.35 74.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.418 -0.355 . . . . 1.22 111.643 -174.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 521' ' ' ILE . . . . . 0.701 HG23 HG23 ' B' ' 520' ' ' VAL . 30.5 pt -90.64 -25.75 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 115.487 1.662 . . . . 1.98 115.487 -175.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.88 -35.24 76.12 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.694 -0.854 . . . . 2.5699999999999998 108.694 173.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 523' ' ' ASP . . . . . 0.404 ' O ' ' HG ' ' B' ' 527' ' ' LEU . 18.5 t70 -92.36 -21.49 20.21 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.037 1.495 . . . . 2.1699999999999999 115.037 -177.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 524' ' ' LEU . . . . . 0.494 HD13 ' O ' ' B' ' 520' ' ' VAL . 5.2 mp -70.61 -45.33 65.46 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.305 -0.628 . . . . 1.48 109.305 168.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . 0.447 HD12 HD23 ' A' ' 17' ' ' LEU . 44.5 tp -52.31 -45.46 65.57 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 121.236 0.541 . . . . 1.95 110.91 169.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . 0.458 ' O ' ' HG2' ' B' ' 529' ' ' GLU . . . -66.5 -40.56 94.33 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -178.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' B' ' 523' ' ' ASP . 74.6 mt -63.57 -36.12 82.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 1.6699999999999999 111.47 175.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 42.4 t -63.5 -47.77 80.36 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.041 -0.527 . . . . 0.58999999999999997 110.634 -175.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 529' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' B' ' 526' ' ' GLY . 10.9 pt-20 -61.58 -29.71 70.2 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.544 -0.753 . . . . 2.5 112.542 173.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -71.62 -54.74 9.43 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.375 0.88 . . . . 2.2400000000000002 113.375 -177.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -68.76 137.95 54.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.0 -0.545 . . . . 2.2799999999999998 111.07 -177.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 532' ' ' ARG . . . . . 0.405 ' HG2' ' N ' ' B' ' 533' ' ' GLY . 68.2 ttt180 -96.46 160.6 14.32 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.813 -0.631 . . . . 4.21 110.16 178.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 533' ' ' GLY . . . . . 0.405 ' N ' ' HG2' ' B' ' 532' ' ' ARG . . . 87.53 119.56 1.37 Allowed Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 115.848 -0.614 . . . . 0.0 114.007 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -47.08 -36.63 8.42 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.241 0.83 . . . . 2.9500000000000002 113.241 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -50.52 -51.92 43.3 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 120.33 -0.548 . . . . 2.2000000000000002 110.851 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 536' ' ' ASN . . . . . 0.498 ' O ' HG22 ' B' ' 539' ' ' ILE . 18.7 m120 -65.95 -44.87 83.74 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.717 0.636 . . . . 1.47 112.717 178.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 537' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -67.76 -32.04 72.36 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.408 -0.517 . . . . 2.5 110.283 -174.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.13 -46.92 69.5 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.896 -0.593 . . . . 0.040000000000000001 111.112 178.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 539' ' ' ILE . . . . . 0.498 HG22 ' O ' ' B' ' 536' ' ' ASN . 0.4 OUTLIER -58.19 -54.92 25.93 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.56 0.695 . . . . 1.8200000000000001 111.307 173.42 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 540' ' ' ILE . . . . . 0.494 ' N ' ' CG2' ' B' ' 539' ' ' ILE . 82.4 mt -56.77 -48.18 81.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.566 -178.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.38 -44.05 84.1 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 113.68 0.993 . . . . 0.02 113.68 179.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 63.4 m -60.43 -38.76 85.11 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.619 -0.432 . . . . 1.2 110.351 -178.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 543' ' ' ASN . . . . . 0.434 ' O ' HG12 ' B' ' 547' ' ' ILE . 42.1 t30 -69.0 -47.14 66.23 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 114.316 1.228 . . . . 2.0299999999999998 114.316 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 544' ' ' ILE . . . . . 0.402 HG12 ' HB3' ' B' ' 524' ' ' LEU . 57.6 mt -52.64 -45.96 48.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.471 -0.937 . . . . 1.8100000000000001 108.471 170.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 545' ' ' MET . . . . . 0.762 ' HB3' HG21 ' B' ' 587' ' ' THR . 50.6 mtp -64.05 -42.24 97.11 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 119.718 -0.793 . . . . 2.6000000000000001 112.828 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -58.37 -48.8 79.42 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 119.272 -0.971 . . . . 2.0800000000000001 109.829 176.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 547' ' ' ILE . . . . . 0.517 ' O ' ' HG2' ' B' ' 550' ' ' GLN . 43.2 mm -55.06 -61.36 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.854 0.687 . . . . 1.5 112.854 179.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 548' ' ' VAL . . . . . 0.617 HG22 HD11 ' B' ' 555' ' ' LEU . 12.4 p -47.41 -44.23 9.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 C-N-CA 119.892 -0.723 . . . . 1.3999999999999999 111.388 176.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.32 -28.1 58.68 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.799 -0.563 . . . . 0.0 112.916 -177.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 550' ' ' GLN . . . . . 0.517 ' HG2' ' O ' ' B' ' 547' ' ' ILE . 7.5 pt20 -87.08 -9.55 55.12 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.598 0.592 . . . . 2.27 112.598 -175.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -120.38 59.69 6.99 Favored Pre-proline 0 CA--C 1.535 0.399 0 N-CA-C 113.773 1.027 . . . . 3.5299999999999998 113.773 -176.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 552' ' ' PRO . . . . . 0.466 ' HD3' ' C ' ' B' ' 550' ' ' GLN . 44.6 Cg_exo -55.96 -39.35 91.72 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.068 0.509 . . . . 0.46000000000000002 113.139 177.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -56.32 -46.67 79.77 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.153 0.501 . . . . 3.8700000000000001 109.968 -174.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -48.93 -59.79 3.3 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 123.956 0.902 . . . . 0.69999999999999996 112.113 167.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 555' ' ' LEU . . . . . 0.617 HD11 HG22 ' B' ' 548' ' ' VAL . 77.4 mt -54.33 -48.6 71.2 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.281 -0.418 . . . . 1.49 110.17 -178.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . 0.44 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 46.5 ttp180 -53.91 -35.9 62.14 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.752 1.019 . . . . 3.0899999999999999 113.752 -178.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.05 -12.13 51.02 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.513 -0.475 . . . . 0.0 112.08 -177.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 558' ' ' HIS . . . . . 0.481 ' ND1' ' HB2' ' B' ' 561' ' ' PHE . 18.7 t-160 -128.28 78.45 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.399 1.259 . . . . 2.9300000000000002 114.399 -177.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 559' ' ' TRP . . . . . 0.573 ' HB2' ' NE2' ' B' ' 603' ' ' GLN . 17.2 p90 -50.39 -48.3 56.02 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 116.613 2.079 . . . . 3.1099999999999999 116.613 -176.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 24.1 ttmm -56.6 -36.69 69.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.265 -0.425 . . . . 3.3199999999999998 111.073 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 561' ' ' PHE . . . . . 0.556 ' O ' HG13 ' B' ' 565' ' ' VAL . 0.1 OUTLIER -74.91 -45.08 45.02 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.061 -1.055 . . . . 1.25 111.897 175.68 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . 0.855 ' O ' HG22 ' B' ' 565' ' ' VAL . 6.4 tt -49.94 -59.12 4.17 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 122.459 0.304 . . . . 1.3200000000000001 110.338 175.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -50.22 -38.64 41.31 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.863 1.061 . . . . 2.7400000000000002 113.863 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 37.8 m -71.81 -39.42 69.86 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.487 0.66 . . . . 1.24 110.294 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 565' ' ' VAL . . . . . 0.855 HG22 ' O ' ' B' ' 562' ' ' LEU . 4.8 m -62.85 -41.28 91.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.687 -0.688 . . . . 1.1899999999999999 112.529 173.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 566' ' ' VAL . . . . . 0.557 HG22 HD12 ' B' ' 591' ' ' ILE . 47.9 t -71.06 -50.84 39.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 C-N-CA 120.537 -0.465 . . . . 1.3600000000000001 110.798 -176.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -51.04 -37.42 45.26 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.035 -0.53 . . . . 1.9399999999999999 112.067 170.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -72.72 -32.58 65.82 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.736 -0.468 . . . . 3.5299999999999998 109.736 -179.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 569' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' B' ' 565' ' ' VAL . 71.3 mt -67.52 -36.53 81.23 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 108.648 -0.871 . . . . 2.0099999999999998 108.648 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -65.29 -39.34 92.42 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.915 -0.402 . . . . 3.77 109.915 178.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.68 -53.58 56.63 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 120.011 -0.676 . . . . 2.4700000000000002 110.465 176.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 572' ' ' PHE . . . . . 0.559 ' HA ' ' HG2' ' B' ' 575' ' ' GLU . 23.5 m-85 -62.44 -9.9 9.91 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.121 1.156 . . . . 1.23 114.121 -177.135 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 573' ' ' MET . . . . . 0.605 ' HB3' HD21 ' B' ' 625' ' ' LEU . 67.9 mtt -76.39 -5.34 46.86 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.648 0.737 . . . . 2.1099999999999999 109.641 178.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -109.43 -0.57 18.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.815 -1.084 . . . . 3.2000000000000002 111.431 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 575' ' ' GLU . . . . . 0.753 ' HB3' HG21 ' B' ' 580' ' ' VAL . 48.4 mm-40 -68.59 130.24 42.26 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 116.195 -0.457 . . . . 1.55 110.124 177.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 64.0 p -87.89 -21.21 25.1 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.026 0.75 . . . . 1.3999999999999999 113.026 -177.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 577' ' ' HIS . . . . . 0.694 ' O ' HG22 ' B' ' 580' ' ' VAL . 64.7 t-80 -60.21 128.0 34.62 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.402 0.62 . . . . 2.8500000000000001 112.528 -175.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -44.85 125.86 5.33 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.397 -0.82 . . . . 2.1499999999999999 113.139 -171.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.72 4.76 Favored Glycine 0 C--O 1.223 -0.567 0 N-CA-C 116.299 1.28 . . . . 0.0 116.299 175.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 580' ' ' VAL . . . . . 0.753 HG21 ' HB3' ' B' ' 575' ' ' GLU . 23.5 m -53.81 -46.31 63.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.096 0.776 . . . . 1.29 113.096 -175.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.495 ' N ' HG23 ' B' ' 580' ' ' VAL . 22.9 mt-30 -59.67 -42.3 92.56 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.371 0.508 . . . . 1.99 112.371 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -60.54 -42.4 96.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 112.232 0.456 . . . . 2.23 112.232 172.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 7.2 tpt -60.68 -49.51 77.21 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.084 -0.246 . . . . 2.5800000000000001 110.453 175.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.7 -43.0 80.11 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.129 -0.487 . . . . 0.029999999999999999 111.81 -177.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 50.2 t -74.35 -40.93 61.82 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.03 -0.668 . . . . 1.5 112.004 -177.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 586' ' ' ASP . . . . . 0.619 ' O ' HG22 ' B' ' 589' ' ' ILE . 0.7 OUTLIER -59.6 -46.29 89.4 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.249 -0.432 . . . . 1.98 111.974 -179.899 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 587' ' ' THR . . . . . 0.762 HG21 ' HB3' ' B' ' 545' ' ' MET . 41.7 p -62.23 -41.23 98.23 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.372 0.669 . . . . 1.3 110.358 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 588' ' ' PHE . . . . . 0.542 ' HA ' HG12 ' B' ' 591' ' ' ILE . 88.2 t80 -61.46 -32.15 72.14 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.118 -0.492 . . . . 0.53000000000000003 111.186 -177.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 589' ' ' ILE . . . . . 0.619 HG22 ' O ' ' B' ' 586' ' ' ASP . 20.1 tt -79.87 -35.95 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.878 -1.929 . . . . 1.97 109.8 -175.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -57.56 -49.86 74.99 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 107.779 -1.193 . . . . 2.6200000000000001 107.779 176.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . 0.557 HD12 HG22 ' B' ' 566' ' ' VAL . 34.5 pt -63.91 -43.64 97.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.784 0.661 . . . . 1.96 112.784 -176.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . 0.498 ' N ' HG13 ' B' ' 591' ' ' ILE . . . -63.94 -39.17 93.53 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.535 -0.466 . . . . 0.0 112.217 177.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 593' ' ' GLN . . . . . 0.495 HE21 ' HA ' ' B' ' 593' ' ' GLN . 0.0 OUTLIER -62.3 -70.14 0.22 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.14 -1.024 . . . . 2.3599999999999999 109.795 174.518 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -56.13 -23.72 36.28 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 116.623 2.082 . . . . 2.1899999999999999 116.623 -176.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 74.8 m -121.66 25.15 9.44 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 114.331 1.234 . . . . 1.26 114.331 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -48.5 -38.52 20.4 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.887 1.81 . . . . 3.5800000000000001 115.887 -172.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . 0.422 ' O ' ' HG2' ' B' ' 601' ' ' GLN . 34.5 ttm180 -69.56 -32.63 71.52 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.242 0.831 . . . . 3.7400000000000002 113.242 -175.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 598' ' ' HIS . . . . . 0.44 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 57.2 m-70 -70.07 -3.84 18.37 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.595 -0.73 . . . . 2.1400000000000001 112.107 -173.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -105.54 -16.88 14.59 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 123.597 0.561 . . . . 2.9500000000000002 110.231 -176.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 35.8 m -105.9 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.11 -0.95 . . . . 1.4199999999999999 111.276 -175.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 601' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' B' ' 597' ' ' ARG . 3.9 pt20 -102.05 139.52 37.57 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 119.563 -0.855 . . . . 2.3399999999999999 111.561 176.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 7.4 m -60.95 122.74 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.597 -0.89 . . . . 1.3700000000000001 108.597 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 603' ' ' GLN . . . . . 0.573 ' NE2' ' HB2' ' B' ' 559' ' ' TRP . 18.9 pt20 -92.79 167.31 11.95 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.631 0.582 . . . . 2.6800000000000002 110.048 -177.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 41.3 t -71.99 129.01 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 N-CA-C 112.958 0.725 . . . . 1.27 112.958 -175.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.35 6.52 64.44 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.059 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 606' ' ' GLU . . . . . 0.537 ' HG3' ' H ' ' B' ' 608' ' ' MET . 8.7 tp10 -131.44 157.97 42.06 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.639 -0.825 . . . . 2.5099999999999998 110.808 175.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 607' ' ' VAL . . . . . 0.538 HG13 ' HG2' ' B' ' 608' ' ' MET . 13.9 p -103.26 -22.46 4.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.097 -0.956 . . . . 1.3999999999999999 112.49 -175.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 608' ' ' MET . . . . . 0.538 ' HG2' HG13 ' B' ' 607' ' ' VAL . 22.2 mmt -137.02 142.22 37.57 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.601 0.593 . . . . 2.6800000000000002 112.601 -174.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 609' ' ' PRO . . . . . 0.542 ' HB2' HG22 ' B' ' 611' ' ' ILE . 9.7 Cg_endo -52.08 130.9 36.93 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.42999999999999999 112.131 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -57.0 -31.84 65.5 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 111.823 0.305 . . . . 2.3700000000000001 111.823 -174.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 611' ' ' ILE . . . . . 0.542 HG22 ' HB2' ' B' ' 609' ' ' PRO . 14.0 tt -50.0 -44.93 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 CA-C-O 120.816 0.341 . . . . 1.8400000000000001 110.496 178.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 612' ' ' ASP . . . . . 0.413 ' N ' HG23 ' B' ' 611' ' ' ILE . 20.9 t70 -49.88 -52.0 36.23 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.646 0.778 . . . . 2.1499999999999999 112.875 177.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -59.95 -37.13 78.67 Favored 'General case' 0 C--O 1.244 0.795 0 C-N-CA 120.59 -0.444 . . . . 2.6600000000000001 110.189 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 614' ' ' ILE . . . . . 0.401 ' O ' ' ND2' ' B' ' 617' ' ' ASN . 73.0 mt -64.45 -48.05 86.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 C-N-CA 120.262 -0.575 . . . . 1.76 111.973 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 59.8 tp -62.6 -31.13 71.91 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.03 0.752 . . . . 1.8400000000000001 113.03 -177.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -79.6 2.16 23.4 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.639 1.348 . . . . 2.0600000000000001 114.639 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 617' ' ' ASN . . . . . 0.606 HD22 ' C ' ' B' ' 617' ' ' ASN . 0.2 OUTLIER -142.42 15.67 2.02 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.117 0.784 . . . . 1.97 113.117 -174.283 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 618' ' ' ILE . . . . . 0.469 HG23 ' N ' ' B' ' 619' ' ' ASN . 13.5 tt -46.87 -46.98 8.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.0099999999999998 110.263 -176.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 619' ' ' ASN . . . . . 0.469 ' N ' HG23 ' B' ' 618' ' ' ILE . 22.7 p-10 -63.24 -51.06 67.74 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.754 1.02 . . . . 2.2799999999999998 113.754 -176.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 620' ' ' THR . . . . . 0.423 ' OG1' ' HB2' ' B' ' 617' ' ' ASN . 56.8 p -56.94 -31.9 65.43 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 119.46 -0.896 . . . . 1.3200000000000001 110.741 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 621' ' ' ILE . . . . . 0.518 HG13 HG23 ' B' ' 622' ' ' ILE . 32.0 pt -79.27 -42.65 23.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.373 1.62 . . . . 2.0 115.373 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 622' ' ' ILE . . . . . 0.518 HG23 HG13 ' B' ' 621' ' ' ILE . 34.7 pt -87.67 -6.25 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 115.069 1.507 . . . . 2.0899999999999999 115.069 -177.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 40.2 t -19.98 -58.32 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.567 2.062 . . . . 1.47 116.567 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -99.23 -7.65 26.16 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.037 -1.438 . . . . 2.0699999999999998 110.994 -163.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 625' ' ' LEU . . . . . 0.605 HD21 ' HB3' ' B' ' 573' ' ' MET . 82.7 mt -71.78 146.9 47.78 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 123.311 0.382 . . . . 1.6699999999999999 111.773 -173.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 626' ' ' GLN . . . . . 0.531 ' HB3' ' HD2' ' B' ' 627' ' ' PRO . 97.2 mt-30 -76.75 162.1 71.64 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 108.827 -0.805 . . . . 2.3500000000000001 108.827 174.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 627' ' ' PRO . . . . . 0.531 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 6.3 Cg_endo -47.85 -43.55 29.14 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.823 1.432 . . . . 0.44 115.823 -178.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -67.32 -43.08 82.52 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.615 -0.513 . . . . 2.6200000000000001 109.615 -174.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -63.29 -38.29 90.58 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.951 -0.568 . . . . 2.0600000000000001 110.9 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 630' ' ' VAL . . . . . 0.459 HG23 ' O ' ' B' ' 626' ' ' GLN . 80.9 t . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.237 -0.887 . . . . 1.3 110.67 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.466 -0.254 . . . . 9.8599999999999994 112.466 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.9 t -135.69 111.55 9.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.752 0.31 . . . . 8.7799999999999994 110.799 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.71 128.69 39.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 6.8200000000000003 111.126 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.4 p -64.37 130.06 42.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 6.25 111.054 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.74 120.86 0.36 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.791 -0.719 . . . . 4.1200000000000001 112.587 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -101.22 -45.74 5.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.722 0.296 . . . . 4.0300000000000002 110.925 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.638 ' HG ' HD22 ' A' ' 10' ' ' LEU . 7.4 mp -73.32 -8.98 58.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.279 -0.419 . . . . 2.21 110.891 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -54.89 -41.96 71.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.064 -0.517 . . . . 3.79 111.232 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.433 ' HG3' HD12 ' A' ' 10' ' ' LEU . 10.3 pt-20 -79.97 -22.65 42.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.309 -0.405 . . . . 4.1699999999999999 111.056 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.638 HD22 ' HG ' ' A' ' 7' ' ' LEU . 10.8 mp -63.58 -23.72 67.5 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.182 -0.463 . . . . 2.5800000000000001 111.047 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.02 -31.63 44.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 2.8399999999999999 111.374 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 24.7 tp -67.13 -18.36 65.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.817 0.341 . . . . 3.6699999999999999 110.715 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -80.71 -39.08 27.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.139 -0.482 . . . . 4.9299999999999997 111.491 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.549 HD21 ' HD3' ' B' ' 568' ' ' LYS . 8.5 tt -60.1 -24.77 64.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.482 -0.326 . . . . 3.27 110.916 -179.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.42 -30.99 54.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 3.1299999999999999 111.093 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -94.54 58.43 1.91 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.761 -0.733 . . . . 2.4700000000000002 112.437 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.571 HD23 ' HD2' ' B' ' 568' ' ' LYS . 14.3 tp -140.02 102.2 4.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.016 0.436 . . . . 2.1400000000000001 110.819 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -155.35 140.67 17.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.857 -0.61 . . . . 3.9199999999999999 110.755 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 15.7 mm -78.56 -13.75 13.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 3.25 110.875 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -148.31 134.96 19.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.128 -0.487 . . . . 5.9500000000000002 110.764 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -74.55 104.5 5.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.324 -0.398 . . . . 9.3900000000000006 110.735 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.7 m -94.94 130.63 41.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.141 -0.482 . . . . 8.9700000000000006 111.149 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -73.13 96.63 2.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.246 -0.433 . . . . 11.67 110.72 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 168.64 127.4 0.91 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.782 -0.723 . . . . 12.859999999999999 112.493 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -107.36 -22.54 12.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.724 0.297 . . . . 15.369999999999999 110.976 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -65.2 160.2 21.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 16.539999999999999 110.868 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 50.5 t . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.231 -0.89 . . . . 17.93 110.802 179.966 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 504' ' ' ILE . . . . . 0.461 ' N ' HD13 ' B' ' 504' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.277 0 N-CA-C 113.094 0.776 . . . . 2.1299999999999999 113.094 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 74.9 m -48.84 119.11 2.94 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.519 0.563 . . . . 1.29 112.519 174.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.79 1.5 67.86 Favored Glycine 0 CA--C 1.526 0.766 0 C-N-CA 120.948 -0.644 . . . . 0.0 114.501 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.4 -7.57 41.21 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 117.549 0.674 . . . . 0.02 112.444 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 24.8 mmt -112.43 159.98 18.2 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.22 0.533 . . . . 2.21 112.262 174.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -69.64 134.28 48.53 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 109.051 -0.722 . . . . 2.6699999999999999 109.051 174.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.78 -35.39 0.79 Allowed 'General case' 0 C--O 1.239 0.533 0 N-CA-C 113.37 0.878 . . . . 2.6600000000000001 113.37 -173.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -73.82 -41.88 61.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.531 -0.759 . . . . 2.4399999999999999 112.1 -176.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -64.85 -40.18 94.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.182 0.515 . . . . 2.0800000000000001 110.873 171.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -53.7 -48.61 69.38 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.285 -0.87 . . . . 1.9199999999999999 111.107 177.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 514' ' ' LYS . . . . . 0.431 ' HE2' ' NE2' ' B' ' 558' ' ' HIS . 9.9 mtpm? -54.86 -57.67 10.66 Favored 'General case' 0 C--O 1.241 0.65 0 N-CA-C 111.889 0.329 . . . . 2.73 111.889 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . 0.445 ' O ' HG23 ' B' ' 519' ' ' THR . 74.5 mtp180 -56.63 -35.85 68.81 Favored 'General case' 0 CA--C 1.504 -0.817 0 O-C-N 124.129 0.893 . . . . 3.75 111.138 -177.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -76.15 -45.63 32.62 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.151 -0.932 . . . . 1.8899999999999999 110.515 -173.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 517' ' ' LEU . . . . . 0.622 ' HA ' HG12 ' B' ' 520' ' ' VAL . 8.2 tt -66.68 -32.26 73.46 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.761 -0.654 . . . . 1.8999999999999999 112.64 177.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 518' ' ' VAL . . . . . 0.52 HG13 HD21 ' A' ' 10' ' ' LEU . 44.6 t -67.47 -35.1 72.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 118.515 -1.274 . . . . 1.3999999999999999 109.081 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 519' ' ' THR . . . . . 0.445 HG23 ' O ' ' B' ' 515' ' ' ARG . 75.9 p -72.93 -36.42 67.22 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.451 0.643 . . . . 1.1799999999999999 112.42 178.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 520' ' ' VAL . . . . . 0.638 HG13 HG23 ' B' ' 521' ' ' ILE . 9.8 p -71.18 -42.36 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 O-C-N 122.094 -0.379 . . . . 1.22 111.673 -174.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 521' ' ' ILE . . . . . 0.638 HG23 HG13 ' B' ' 520' ' ' VAL . 26.2 pt -90.64 -25.8 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.442 1.645 . . . . 1.98 115.442 -175.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -60.82 -35.21 75.95 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.657 -0.868 . . . . 2.5699999999999998 108.657 173.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 523' ' ' ASP . . . . . 0.457 ' O ' HD23 ' B' ' 527' ' ' LEU . 10.0 m-20 -92.43 -21.46 20.18 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.987 1.477 . . . . 2.1699999999999999 114.987 -177.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 524' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' B' ' 520' ' ' VAL . 84.3 mt -70.6 -45.46 65.27 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 109.275 -0.639 . . . . 1.48 109.275 169.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . 0.683 HD22 HD13 ' B' ' 544' ' ' ILE . 3.7 mm? -52.16 -45.46 65.08 Favored 'General case' 0 C--O 1.246 0.881 0 CA-C-O 121.28 0.562 . . . . 1.95 110.97 169.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.5 -40.59 94.34 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 -178.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . 0.457 HD23 ' O ' ' B' ' 523' ' ' ASP . 2.5 mm? -63.57 -36.12 82.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 1.6699999999999999 111.47 175.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 528' ' ' CYS . . . . . 0.406 ' HA ' HG21 ' B' ' 540' ' ' ILE . 44.1 t -63.55 -47.6 80.9 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.041 -0.527 . . . . 0.58999999999999997 110.709 -175.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -61.78 -29.57 70.23 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.518 -0.764 . . . . 2.5 112.585 173.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -71.64 -54.76 9.35 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.358 0.873 . . . . 2.2400000000000002 113.358 -177.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -68.77 137.97 54.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.97 -0.559 . . . . 2.2799999999999998 111.002 -177.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 532' ' ' ARG . . . . . 0.434 ' HG2' ' N ' ' B' ' 533' ' ' GLY . 52.6 ttt180 -96.43 160.74 14.25 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.773 -0.649 . . . . 4.21 110.208 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 533' ' ' GLY . . . . . 0.434 ' N ' ' HG2' ' B' ' 532' ' ' ARG . . . 87.46 119.63 1.36 Allowed Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 115.982 -0.554 . . . . 0.0 113.954 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 534' ' ' LYS . . . . . 0.731 ' HD3' ' H ' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.04 -36.72 8.31 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.172 0.804 . . . . 2.9500000000000002 113.172 177.234 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -50.61 -51.8 45.33 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.868 -0.52 . . . . 2.2000000000000002 110.809 174.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 536' ' ' ASN . . . . . 0.581 ' O ' HG22 ' B' ' 539' ' ' ILE . 40.0 m-80 -66.13 -44.77 83.26 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.603 0.594 . . . . 1.47 112.603 178.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 537' ' ' LYS . . . . . 0.565 ' HA ' HG22 ' B' ' 540' ' ' ILE . 96.8 mttt -67.88 -31.95 72.1 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.427 -0.509 . . . . 2.5 110.331 -174.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.08 -46.97 69.53 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.822 -0.626 . . . . 0.040000000000000001 111.149 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 539' ' ' ILE . . . . . 0.581 HG22 ' O ' ' B' ' 536' ' ' ASN . 10.2 tp -58.1 -54.99 24.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 121.542 0.687 . . . . 1.8200000000000001 111.26 173.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 540' ' ' ILE . . . . . 0.565 HG22 ' HA ' ' B' ' 537' ' ' LYS . 10.0 tp -56.83 -48.07 81.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 121.672 -0.642 . . . . 1.8500000000000001 110.581 -178.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 541' ' ' ALA . . . . . 0.427 ' N ' HG23 ' B' ' 540' ' ' ILE . . . -57.55 -44.03 84.9 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 113.545 0.943 . . . . 0.02 113.545 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 542' ' ' SER . . . . . 0.478 ' HA ' ' HG2' ' B' ' 583' ' ' MET . 96.0 p -60.47 -38.72 85.14 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.625 -0.43 . . . . 1.2 110.297 -178.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 543' ' ' ASN . . . . . 0.45 ' O ' HG12 ' B' ' 547' ' ' ILE . 27.4 t-20 -69.08 -47.08 66.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 114.339 1.237 . . . . 2.0299999999999998 114.339 -175.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 544' ' ' ILE . . . . . 0.683 HD13 HD22 ' B' ' 525' ' ' LEU . 45.2 mt -52.71 -45.88 49.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.479 -0.934 . . . . 1.8100000000000001 108.479 170.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 545' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -64.02 -42.32 97.14 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.778 -0.769 . . . . 2.6000000000000001 112.766 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -58.33 -48.81 79.34 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 119.234 -0.986 . . . . 2.0800000000000001 109.845 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 547' ' ' ILE . . . . . 0.45 HG12 ' O ' ' B' ' 543' ' ' ASN . 44.8 mm -55.06 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.77 0.656 . . . . 1.5 112.77 179.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 548' ' ' VAL . . . . . 0.526 HG12 HD11 ' B' ' 555' ' ' LEU . 86.4 t -47.37 -44.22 8.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 C-N-CA 119.837 -0.745 . . . . 1.3999999999999999 111.454 176.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.41 -28.08 58.9 Favored Glycine 0 C--O 1.237 0.319 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -87.06 -9.48 55.35 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.571 0.582 . . . . 2.27 112.571 -175.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -120.4 59.64 7.0 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 113.79 1.033 . . . . 3.5299999999999998 113.79 -176.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -56.04 -39.3 92.05 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 O-C-N 122.189 0.573 . . . . 0.46000000000000002 113.132 178.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -56.39 -46.66 80.01 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 121.074 0.464 . . . . 3.8700000000000001 109.924 -174.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -48.9 -59.75 3.33 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 123.896 0.879 . . . . 0.69999999999999996 112.125 167.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 555' ' ' LEU . . . . . 0.607 ' HB3' HD13 ' B' ' 562' ' ' LEU . 83.8 mt -54.38 -48.58 71.36 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.304 -0.407 . . . . 1.49 110.158 -178.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . 0.472 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 76.8 ttt180 -53.83 -35.91 61.97 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 113.814 1.042 . . . . 3.0899999999999999 113.814 -178.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.09 -12.13 50.91 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.486 -0.486 . . . . 0.0 112.08 -177.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 558' ' ' HIS . . . . . 0.431 ' NE2' ' HE2' ' B' ' 514' ' ' LYS . 94.7 m-70 -128.28 78.48 1.84 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.405 1.261 . . . . 2.9300000000000002 114.405 -177.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 559' ' ' TRP . . . . . 0.599 ' HB2' HE21 ' B' ' 603' ' ' GLN . 38.8 p90 -50.55 -48.25 57.48 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.505 2.039 . . . . 3.1099999999999999 116.505 -176.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.66 -36.62 69.76 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.378 -0.374 . . . . 3.3199999999999998 111.132 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 561' ' ' PHE . . . . . 0.465 ' O ' HG23 ' B' ' 565' ' ' VAL . 0.6 OUTLIER -74.9 -45.13 44.83 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 119.16 -1.016 . . . . 1.25 111.952 175.575 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . 0.607 HD13 ' HB3' ' B' ' 555' ' ' LEU . 58.5 tp -49.94 -59.22 4.07 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 122.428 0.291 . . . . 1.3200000000000001 110.264 174.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -50.11 -38.73 40.23 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.835 1.05 . . . . 2.7400000000000002 113.835 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 87.4 m -71.75 -39.35 70.09 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.553 0.692 . . . . 1.24 110.429 -176.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 565' ' ' VAL . . . . . 0.465 HG11 HG11 ' B' ' 548' ' ' VAL . 67.2 t -62.92 -41.15 91.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.618 -0.719 . . . . 1.1899999999999999 112.551 173.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 566' ' ' VAL . . . . . 0.478 HG23 ' O ' ' B' ' 562' ' ' LEU . 43.1 t -71.08 -50.89 39.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 120.546 -0.462 . . . . 1.3600000000000001 110.819 -176.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 567' ' ' ASN . . . . . 0.404 ' O ' ' HG2' ' B' ' 571' ' ' GLU . 3.7 t-20 -51.1 -37.39 45.58 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.951 -0.568 . . . . 1.9399999999999999 112.029 170.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 568' ' ' LYS . . . . . 0.571 ' HD2' HD23 ' A' ' 17' ' ' LEU . 33.1 ttpt -72.6 -32.77 66.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.67 -0.493 . . . . 3.5299999999999998 109.67 -179.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 569' ' ' LEU . . . . . 0.84 HD11 ' O ' ' B' ' 584' ' ' ALA . 1.8 tm? -67.44 -36.46 81.26 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.739 -0.837 . . . . 2.0099999999999998 108.739 177.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 570' ' ' PHE . . . . . 0.439 ' CE2' HG12 ' B' ' 566' ' ' VAL . 24.6 m-85 -65.41 -39.31 92.0 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.863 -0.421 . . . . 3.77 109.863 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' B' ' 567' ' ' ASN . 18.7 mm-40 -57.67 -53.56 56.78 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 119.908 -0.717 . . . . 2.4700000000000002 110.479 176.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -62.36 -10.03 10.02 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.108 1.151 . . . . 1.23 114.108 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 573' ' ' MET . . . . . 0.794 ' HB3' HD11 ' B' ' 625' ' ' LEU . 18.0 mtm -76.35 -5.34 46.74 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.616 0.722 . . . . 2.1099999999999999 109.641 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 29.6 m-70 -109.42 -0.61 18.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.815 -1.084 . . . . 3.2000000000000002 111.452 173.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 575' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -68.51 130.2 42.18 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.212 -0.449 . . . . 1.55 110.083 177.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 7.9 t -87.81 -21.32 25.14 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.027 0.751 . . . . 1.3999999999999999 113.027 -177.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 577' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -60.19 128.02 34.71 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.409 0.623 . . . . 2.8500000000000001 112.532 -175.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -44.89 125.91 5.4 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.315 -0.857 . . . . 2.1499999999999999 113.011 -171.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.2 -34.76 4.74 Favored Glycine 0 C--O 1.222 -0.643 0 N-CA-C 116.323 1.289 . . . . 0.0 116.323 174.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 580' ' ' VAL . . . . . . . . . . . . . 45.2 t -53.72 -46.37 62.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 113.186 0.81 . . . . 1.29 113.186 -175.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.578 ' HB2' HE22 ' B' ' 629' ' ' GLN . 3.3 pt20 -59.63 -42.31 92.43 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.384 0.513 . . . . 1.99 112.384 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -60.46 -42.45 96.22 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.168 0.433 . . . . 2.23 112.168 172.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 583' ' ' MET . . . . . 0.478 ' HG2' ' HA ' ' B' ' 542' ' ' SER . 37.1 tpp -60.74 -49.42 77.59 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 121.027 -0.269 . . . . 2.5800000000000001 110.431 175.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 584' ' ' ALA . . . . . 0.84 ' O ' HD11 ' B' ' 569' ' ' LEU . . . -56.85 -42.96 80.65 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.162 -0.472 . . . . 0.029999999999999999 111.692 -177.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 52.6 t -74.36 -40.93 61.8 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 120.041 -0.664 . . . . 1.5 111.943 -177.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 586' ' ' ASP . . . . . 0.632 ' O ' HG22 ' B' ' 589' ' ' ILE . 15.5 t70 -59.7 -46.26 89.63 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.312 -0.404 . . . . 1.98 111.935 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 46.8 m -62.15 -41.23 98.09 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 123.433 0.693 . . . . 1.3 110.39 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -61.5 -32.17 72.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.075 -0.511 . . . . 0.53000000000000003 111.142 -177.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 589' ' ' ILE . . . . . 0.632 HG22 ' O ' ' B' ' 586' ' ' ASP . 8.9 tp -79.95 -35.91 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.847 -1.941 . . . . 1.97 109.854 -175.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . 0.457 ' HB3' ' NZ ' ' B' ' 590' ' ' LYS . 3.7 mmmp? -57.46 -49.99 74.49 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 107.747 -1.205 . . . . 2.6200000000000001 107.747 176.025 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 87.8 mt -63.83 -43.76 97.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.725 -0.671 . . . . 1.96 112.739 -176.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.14 93.45 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.512 -0.475 . . . . 0.0 112.244 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -62.26 -70.19 0.21 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.222 -0.991 . . . . 2.3599999999999999 109.796 174.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -56.1 -23.86 36.72 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.562 2.06 . . . . 2.1899999999999999 116.562 -176.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 75.0 m -121.68 25.24 9.38 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.261 1.208 . . . . 1.26 114.261 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -48.48 -38.54 20.32 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.861 1.8 . . . . 3.5800000000000001 115.861 -172.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -69.56 -32.66 71.57 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.186 0.809 . . . . 3.7400000000000002 113.186 -175.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 598' ' ' HIS . . . . . 0.472 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 55.1 m-70 -70.12 -3.85 18.6 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.617 -0.72 . . . . 2.1400000000000001 112.072 -173.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -105.58 -16.93 14.57 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.585 0.553 . . . . 2.9500000000000002 110.228 -176.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 46.5 t -105.82 -24.39 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.017 -0.992 . . . . 1.4199999999999999 111.295 -175.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -101.99 139.5 37.54 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.547 -0.861 . . . . 2.3399999999999999 111.599 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 4.3 p -60.91 122.7 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 N-CA-C 108.599 -0.889 . . . . 1.3700000000000001 108.599 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 603' ' ' GLN . . . . . 0.599 HE21 ' HB2' ' B' ' 559' ' ' TRP . 5.1 mt-30 -92.68 167.3 11.99 Favored 'General case' 0 C--O 1.224 -0.253 0 O-C-N 123.706 0.629 . . . . 2.6800000000000002 110.138 -177.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.01 129.08 35.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 C-N-CA 119.881 -0.728 . . . . 1.27 112.907 -175.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.26 6.58 64.55 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.069 -175.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 606' ' ' GLU . . . . . 0.555 ' HG3' ' H ' ' B' ' 608' ' ' MET . 9.1 tp10 -131.46 158.03 41.92 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.611 -0.836 . . . . 2.5099999999999998 110.78 175.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 33.3 m -103.24 -22.58 4.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.13 -0.941 . . . . 1.3999999999999999 112.582 -175.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 608' ' ' MET . . . . . 0.555 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 23.2 ptt? -136.92 142.25 37.89 Favored Pre-proline 0 C--O 1.223 -0.297 0 N-CA-C 112.611 0.597 . . . . 2.6800000000000002 112.611 -174.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.08 130.89 36.92 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.42999999999999999 112.131 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 610' ' ' PHE . . . . . 0.459 ' CE2' HD11 ' B' ' 614' ' ' ILE . 16.5 t80 -57.01 -31.87 65.55 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.792 0.293 . . . . 2.3700000000000001 111.792 -174.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 611' ' ' ILE . . . . . 0.403 HG23 ' N ' ' B' ' 612' ' ' ASP . 11.8 tt -50.05 -44.8 22.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.85 0.357 . . . . 1.8400000000000001 110.56 178.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 612' ' ' ASP . . . . . 0.403 ' N ' HG23 ' B' ' 611' ' ' ILE . 16.7 t70 -49.92 -52.01 36.57 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.623 0.769 . . . . 2.1499999999999999 112.906 177.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -59.84 -37.17 78.47 Favored 'General case' 0 C--O 1.242 0.679 0 C-N-CA 120.604 -0.438 . . . . 2.6600000000000001 110.223 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 614' ' ' ILE . . . . . 0.459 HD11 ' CE2' ' B' ' 610' ' ' PHE . 31.9 mm -64.55 -47.98 86.87 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.181 -0.607 . . . . 1.76 111.922 178.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 8.4 tt -62.63 -31.11 71.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.98 0.733 . . . . 1.8400000000000001 112.98 -177.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -79.57 2.15 23.36 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.61 1.337 . . . . 2.0600000000000001 114.61 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -142.41 15.66 2.02 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 113.103 0.779 . . . . 1.97 113.103 -174.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 618' ' ' ILE . . . . . 0.502 ' N ' HD13 ' B' ' 618' ' ' ILE . 0.2 OUTLIER -47.0 -46.98 8.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 C-N-CA 118.957 -1.097 . . . . 2.0099999999999998 110.183 -176.663 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 619' ' ' ASN . . . . . 0.494 ' N ' HG12 ' B' ' 618' ' ' ILE . 6.0 p30 -63.19 -51.11 67.65 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.759 1.022 . . . . 2.2799999999999998 113.759 -176.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 76.3 p -56.85 -31.88 65.23 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 119.449 -0.9 . . . . 1.3200000000000001 110.804 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 621' ' ' ILE . . . . . 0.548 HG13 HG12 ' B' ' 622' ' ' ILE . 42.0 pt -79.35 -42.62 23.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.322 1.601 . . . . 2.0 115.322 -179.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 622' ' ' ILE . . . . . 0.694 ' HA ' HD13 ' B' ' 625' ' ' LEU . 19.7 mm -87.72 -6.26 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 115.035 1.494 . . . . 2.0899999999999999 115.035 -177.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.6 t -19.98 -58.29 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.567 2.062 . . . . 1.47 116.567 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -99.27 -7.58 26.18 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.063 -1.426 . . . . 2.0699999999999998 111.022 -163.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 625' ' ' LEU . . . . . 0.794 HD11 ' HB3' ' B' ' 573' ' ' MET . 8.3 mp -71.83 146.82 47.74 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.409 -0.36 . . . . 1.6699999999999999 111.7 -173.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 626' ' ' GLN . . . . . 0.724 ' O ' HG13 ' B' ' 630' ' ' VAL . 18.9 pt20 -76.65 162.13 71.68 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 108.814 -0.81 . . . . 2.3500000000000001 108.814 174.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 627' ' ' PRO . . . . . 0.787 ' O ' HG22 ' B' ' 630' ' ' VAL . 79.4 Cg_exo -47.96 -43.51 29.86 Favored 'Trans proline' 0 C--O 1.233 0.263 0 N-CA-C 115.827 1.434 . . . . 0.44 115.827 -178.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 628' ' ' GLN . . . . . 0.455 ' NE2' ' HB2' ' B' ' 627' ' ' PRO . 2.0 mp0 -67.33 -43.01 82.65 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.602 -0.518 . . . . 2.6200000000000001 109.602 -174.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 629' ' ' GLN . . . . . 0.578 HE22 ' HB2' ' B' ' 581' ' ' GLN . 28.9 mt-30 -63.23 -38.34 90.8 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.944 -0.571 . . . . 2.0600000000000001 110.928 178.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 630' ' ' VAL . . . . . 0.787 HG22 ' O ' ' B' ' 627' ' ' PRO . 1.0 OUTLIER . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.213 -0.898 . . . . 1.3 110.669 176.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.202 0 N-CA-C 112.377 -0.289 . . . . 9.8599999999999994 112.377 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.4 m -111.09 85.0 2.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.799 0.333 . . . . 8.7799999999999994 110.77 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -153.97 73.88 0.96 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.077 -0.51 . . . . 6.8200000000000003 111.009 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 77.4 p -118.79 -58.38 1.96 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.133 -0.485 . . . . 6.25 110.987 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -94.34 123.75 7.63 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.741 -0.742 . . . . 4.1200000000000001 112.512 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.405 ' O ' ' HG2' ' A' ' 9' ' ' GLU . 39.1 t-20 -164.48 -30.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.789 0.328 . . . . 4.0300000000000002 110.874 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.436 ' N ' HD12 ' A' ' 7' ' ' LEU . 6.7 mp -80.41 -9.57 59.75 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.36 -0.382 . . . . 2.21 111.077 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -56.57 -31.62 64.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.227 -0.442 . . . . 3.79 111.457 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 6' ' ' ASN . 10.0 pt-20 -79.37 -22.76 43.94 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.769 0.319 . . . . 4.1699999999999999 111.252 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.5 mt -66.08 -10.84 44.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.392 -0.367 . . . . 2.5800000000000001 111.062 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.79 -45.14 25.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 2.8399999999999999 111.38 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 69.2 mt -61.98 -14.36 34.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.321 -0.4 . . . . 3.6699999999999999 111.243 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.421 ' HE3' ' HG3' ' B' ' 522' ' ' LYS . 24.8 ttmm -79.78 -37.91 34.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 4.9299999999999997 111.097 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.536 HD23 ' HB ' ' B' ' 564' ' ' THR . 69.5 tp -60.92 -17.86 53.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.388 -0.369 . . . . 3.27 110.995 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.24 -27.61 35.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.324 -0.398 . . . . 3.1299999999999999 110.997 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -92.94 90.48 1.44 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.786 -0.721 . . . . 2.4700000000000002 112.307 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.401 ' HG ' ' HZ ' ' B' ' 572' ' ' PHE . 40.3 tp -165.73 87.79 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.06 0.457 . . . . 2.1400000000000001 110.842 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -137.31 131.08 31.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.927 -0.579 . . . . 3.9199999999999999 110.731 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.496 HG23 ' HB2' ' B' ' 537' ' ' LYS . 73.7 mt -83.33 -30.21 8.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.493 . . . . 3.25 111.139 -179.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -79.84 -20.64 45.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.263 -0.426 . . . . 5.9500000000000002 111.571 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -63.22 126.8 28.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.686 0.279 . . . . 9.3900000000000006 110.943 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.2 t -156.63 -29.66 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.147 -0.479 . . . . 8.9700000000000006 110.849 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -117.89 130.6 56.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.96 -0.563 . . . . 11.67 110.74 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 118.57 115.85 2.66 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.781 -0.723 . . . . 12.859999999999999 112.479 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -84.58 122.05 28.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.727 0.298 . . . . 15.369999999999999 110.907 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -140.88 -39.29 0.42 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 16.539999999999999 110.846 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 52.1 t . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.289 -0.862 . . . . 17.93 111.002 -179.95 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 504' ' ' ILE . . . . . 0.939 HG13 ' HB3' ' B' ' 507' ' ' ALA . 8.0 tp . . . . . 0 C--O 1.236 0.342 0 N-CA-C 112.985 0.735 . . . . 2.1299999999999999 112.985 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . 0.439 ' HB3' ' HG2' ' B' ' 550' ' ' GLN . 79.5 p -48.9 119.16 3.0 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.553 0.575 . . . . 1.29 112.553 174.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.86 1.38 67.78 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.92 -0.657 . . . . 0.0 114.407 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 507' ' ' ALA . . . . . 0.939 ' HB3' HG13 ' B' ' 504' ' ' ILE . . . -94.26 -7.6 41.55 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 117.677 0.738 . . . . 0.02 112.48 176.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 26.4 mmt -112.47 159.93 18.27 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.107 -0.497 . . . . 2.21 112.269 174.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 509' ' ' HIS . . . . . 0.405 ' HD2' ' HB2' ' B' ' 511' ' ' GLU . 82.3 t60 -69.7 134.24 48.43 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 109.14 -0.689 . . . . 2.6699999999999999 109.14 174.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 510' ' ' GLU . . . . . 0.486 ' HG2' ' HE2' ' B' ' 514' ' ' LYS . 40.6 tt0 -41.65 -35.43 0.76 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 113.375 0.88 . . . . 2.6600000000000001 113.375 -173.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 511' ' ' GLU . . . . . 0.405 ' HB2' ' HD2' ' B' ' 509' ' ' HIS . 0.6 OUTLIER -73.73 -42.03 61.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.621 -0.718 . . . . 2.4399999999999999 112.118 -176.587 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -64.84 -40.1 94.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.129 0.49 . . . . 2.0800000000000001 110.855 171.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . 0.411 ' O ' ' HG ' ' B' ' 517' ' ' LEU . 36.4 tt0 -53.72 -48.65 69.39 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.369 -0.832 . . . . 1.9199999999999999 111.183 177.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 514' ' ' LYS . . . . . 0.487 ' O ' HG23 ' B' ' 518' ' ' VAL . 66.3 mttm -54.84 -57.56 11.1 Favored 'General case' 0 C--O 1.241 0.636 0 N-CA-C 111.93 0.345 . . . . 2.73 111.93 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -56.66 -35.84 68.86 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 124.157 0.911 . . . . 3.75 111.116 -177.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -76.26 -45.51 32.35 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.121 -0.945 . . . . 1.8899999999999999 110.502 -173.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 517' ' ' LEU . . . . . 0.608 ' HA ' HG12 ' B' ' 520' ' ' VAL . 91.0 mt -66.77 -32.25 73.41 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.757 -0.656 . . . . 1.8999999999999999 112.596 177.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 518' ' ' VAL . . . . . 0.487 HG23 ' O ' ' B' ' 514' ' ' LYS . 78.5 t -67.45 -35.15 72.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 118.495 -1.282 . . . . 1.3999999999999999 109.021 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 41.4 p -72.98 -36.26 67.04 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.311 0.577 . . . . 1.1799999999999999 112.401 178.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 520' ' ' VAL . . . . . 0.608 HG12 ' HA ' ' B' ' 517' ' ' LEU . 9.3 p -71.3 -42.37 74.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 116.48 -0.327 . . . . 1.22 111.588 -174.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 521' ' ' ILE . . . . . 0.617 HG22 ' CD1' ' B' ' 547' ' ' ILE . 15.5 pt -90.57 -25.82 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 N-CA-C 115.455 1.65 . . . . 1.98 115.455 -175.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 522' ' ' LYS . . . . . 0.421 ' HG3' ' HE3' ' A' ' 13' ' ' LYS . 34.1 ttmt -60.89 -35.16 75.91 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.682 -0.858 . . . . 2.5699999999999998 108.682 173.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -92.45 -21.49 20.15 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 114.988 1.477 . . . . 2.1699999999999999 114.988 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 77.5 mt -70.6 -45.36 65.44 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.295 -0.631 . . . . 1.48 109.295 168.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 83.9 mt -52.3 -45.45 65.54 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.222 0.534 . . . . 1.95 110.942 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.5 -40.54 94.34 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 73.4 mt -63.52 -36.18 82.94 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.033 0.444 . . . . 1.6699999999999999 111.437 175.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 42.3 t -63.47 -47.83 80.19 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.082 -0.508 . . . . 0.58999999999999997 110.63 -175.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.64 -29.6 70.16 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.438 -0.801 . . . . 2.5 112.616 173.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -71.72 -54.65 9.59 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.341 0.867 . . . . 2.2400000000000002 113.341 -177.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 17.1 tptp -68.76 137.95 54.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.008 -0.542 . . . . 2.2799999999999998 111.031 -177.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 532' ' ' ARG . . . . . 0.434 ' HA ' ' NZ ' ' B' ' 537' ' ' LYS . 16.3 ptp180 -96.43 160.72 14.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.765 -0.652 . . . . 4.21 110.19 178.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.39 119.58 1.34 Allowed Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.918 -0.583 . . . . 0.0 114.018 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 534' ' ' LYS . . . . . 0.409 ' HG2' HG22 ' A' ' 19' ' ' ILE . 56.9 mtpt -46.99 -36.71 8.07 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.187 0.81 . . . . 2.9500000000000002 113.187 177.205 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -50.53 -51.86 43.95 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 120.337 -0.545 . . . . 2.2000000000000002 110.799 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 -66.09 -44.82 83.3 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.621 0.601 . . . . 1.47 112.621 178.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 537' ' ' LYS . . . . . 0.496 ' HB2' HG23 ' A' ' 19' ' ' ILE . 63.1 mttp -67.8 -32.08 72.39 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.468 -0.493 . . . . 2.5 110.258 -174.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.1 -46.93 69.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.835 -0.62 . . . . 0.040000000000000001 111.117 178.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 45.4 mm -58.15 -54.97 25.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-O 121.622 0.725 . . . . 1.8200000000000001 111.315 173.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 540' ' ' ILE . . . . . . . . . . . . . 82.8 mt -56.73 -48.19 81.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.663 -0.648 . . . . 1.8500000000000001 110.592 -178.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.43 -44.05 84.35 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.577 0.954 . . . . 0.02 113.577 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 542' ' ' SER . . . . . 0.436 ' HA ' ' HG2' ' B' ' 583' ' ' MET . 88.9 p -60.5 -38.78 85.43 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.571 -0.451 . . . . 1.2 110.297 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -68.96 -47.09 66.5 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.407 1.262 . . . . 2.0299999999999998 114.407 -175.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 544' ' ' ILE . . . . . 0.49 ' O ' HG12 ' B' ' 547' ' ' ILE . 61.2 mt -52.67 -45.89 49.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.539 -0.912 . . . . 1.8100000000000001 108.539 170.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 545' ' ' MET . . . . . 0.837 ' HB3' HG21 ' B' ' 587' ' ' THR . 0.2 OUTLIER -64.08 -42.31 97.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.693 -0.803 . . . . 2.6000000000000001 112.825 179.389 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -58.19 -48.84 79.06 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 119.197 -1.001 . . . . 2.0800000000000001 109.962 176.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 547' ' ' ILE . . . . . 0.617 ' CD1' HG22 ' B' ' 521' ' ' ILE . 38.1 pt -55.02 -61.43 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.856 0.687 . . . . 1.5 112.856 179.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 548' ' ' VAL . . . . . 0.446 HG12 ' HA ' ' B' ' 545' ' ' MET . 10.2 p -47.3 -44.26 8.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 C-N-CA 119.784 -0.767 . . . . 1.3999999999999999 111.446 176.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.37 -28.07 58.8 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.823 -0.548 . . . . 0.0 112.976 -177.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 550' ' ' GLN . . . . . 0.439 ' HG2' ' HB3' ' B' ' 505' ' ' SER . 47.3 tt0 -87.01 -9.55 55.27 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 112.601 0.593 . . . . 2.27 112.601 -175.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -120.48 59.72 7.2 Favored Pre-proline 0 CA--C 1.536 0.44 0 N-CA-C 113.792 1.034 . . . . 3.5299999999999998 113.792 -176.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -55.97 -39.34 91.78 Favored 'Trans proline' 0 C--O 1.222 -0.311 0 O-C-N 122.122 0.538 . . . . 0.46000000000000002 113.246 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 17.0 tpp180 -56.35 -46.66 79.88 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 121.022 0.439 . . . . 3.8700000000000001 109.88 -174.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -49.0 -59.69 3.4 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 123.967 0.907 . . . . 0.69999999999999996 112.098 168.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 555' ' ' LEU . . . . . 0.401 ' HG ' ' CB ' ' B' ' 562' ' ' LEU . 4.7 tp -54.33 -48.64 71.15 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 116.272 -0.422 . . . . 1.49 110.219 -179.015 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . 0.597 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 64.9 ttt180 -53.84 -35.93 62.01 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 113.739 1.015 . . . . 3.0899999999999999 113.739 -178.228 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.06 -12.16 50.89 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.486 -0.486 . . . . 0.0 112.047 -177.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -128.24 78.56 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 2.9300000000000002 114.388 -177.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.57 -48.25 57.59 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.55 2.055 . . . . 3.1099999999999999 116.55 -176.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 560' ' ' LYS . . . . . 0.459 ' O ' HG23 ' B' ' 564' ' ' THR . 75.6 mmtt -56.68 -36.65 69.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 3.3199999999999998 111.121 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 561' ' ' PHE . . . . . 0.457 ' O ' HG23 ' B' ' 565' ' ' VAL . 1.2 t80 -74.82 -45.09 45.66 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.142 -1.023 . . . . 1.25 112.009 175.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . 0.532 HD21 ' HE1' ' B' ' 599' ' ' PHE . 9.6 tt -50.07 -59.04 4.29 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.597 -0.274 . . . . 1.3200000000000001 110.306 175.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -50.26 -38.62 41.78 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.805 1.039 . . . . 2.7400000000000002 113.805 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 564' ' ' THR . . . . . 0.536 ' HB ' HD23 ' A' ' 14' ' ' LEU . 26.1 p -71.76 -39.43 70.01 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.534 0.683 . . . . 1.24 110.38 -176.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 565' ' ' VAL . . . . . 0.457 HG23 ' O ' ' B' ' 561' ' ' PHE . 95.7 t -62.8 -41.37 92.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.577 -0.738 . . . . 1.1899999999999999 112.511 173.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 566' ' ' VAL . . . . . 0.559 HG22 HD12 ' B' ' 591' ' ' ILE . 46.3 t -70.99 -50.87 39.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 120.621 -0.432 . . . . 1.3600000000000001 110.795 -176.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -51.11 -37.43 45.93 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.075 -0.511 . . . . 1.9399999999999999 111.987 170.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -72.67 -32.63 65.96 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.733 -0.469 . . . . 3.5299999999999998 109.733 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 569' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' B' ' 565' ' ' VAL . 54.1 mt -67.51 -36.47 81.11 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 108.703 -0.851 . . . . 2.0099999999999998 108.703 177.072 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 570' ' ' PHE . . . . . 0.456 ' HD1' HG23 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.39 -39.43 92.21 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.851 -0.425 . . . . 3.77 109.851 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -57.52 -53.64 55.89 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 119.97 -0.692 . . . . 2.4700000000000002 110.52 176.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 572' ' ' PHE . . . . . 0.401 ' HZ ' ' HG ' ' A' ' 17' ' ' LEU . 3.1 m-85 -62.36 -9.99 9.9 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 114.092 1.145 . . . . 1.23 114.092 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 573' ' ' MET . . . . . 0.842 ' HB3' HD21 ' B' ' 625' ' ' LEU . 89.5 mtp -76.35 -5.37 46.84 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.614 0.721 . . . . 2.1099999999999999 109.641 178.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 60.6 m80 -109.39 -0.59 18.92 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.78 -1.1 . . . . 3.2000000000000002 111.465 173.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 575' ' ' GLU . . . . . 0.616 ' CG ' HG11 ' B' ' 580' ' ' VAL . 8.1 tp10 -68.46 130.18 42.11 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.193 -0.458 . . . . 1.55 110.162 177.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 72.4 p -87.84 -21.35 25.08 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 112.991 0.737 . . . . 1.3999999999999999 112.991 -177.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 577' ' ' HIS . . . . . 0.781 ' O ' HG12 ' B' ' 580' ' ' VAL . 11.8 t60 -60.2 128.03 34.76 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.364 0.602 . . . . 2.8500000000000001 112.596 -175.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -44.9 125.88 5.4 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.388 -0.824 . . . . 2.1499999999999999 113.103 -171.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.19 -34.65 4.81 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 116.207 1.243 . . . . 0.0 116.207 174.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 580' ' ' VAL . . . . . 0.781 HG12 ' O ' ' B' ' 577' ' ' HIS . 13.4 p -53.75 -46.34 62.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.154 0.798 . . . . 1.29 113.154 -175.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.525 ' N ' HG13 ' B' ' 580' ' ' VAL . 10.9 pt20 -59.67 -42.29 92.56 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.365 0.506 . . . . 1.99 112.365 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -60.56 -42.36 96.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 112.243 0.461 . . . . 2.23 112.243 172.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 583' ' ' MET . . . . . 0.436 ' HG2' ' HA ' ' B' ' 542' ' ' SER . 40.0 tpp -60.71 -49.45 77.47 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 121.126 -0.229 . . . . 2.5800000000000001 110.432 175.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.83 -43.06 80.68 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.196 -0.456 . . . . 0.029999999999999999 111.634 -177.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 52.2 t -74.32 -40.92 61.9 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 119.997 -0.681 . . . . 1.5 112.025 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -59.55 -46.41 88.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.415 . . . . 1.98 111.886 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 587' ' ' THR . . . . . 0.837 HG21 ' HB3' ' B' ' 545' ' ' MET . 81.4 p -62.16 -41.22 98.09 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.3 110.43 175.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 588' ' ' PHE . . . . . 0.545 ' HA ' HG12 ' B' ' 591' ' ' ILE . 88.7 t80 -61.5 -32.09 72.11 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.085 -0.507 . . . . 0.53000000000000003 111.189 -177.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 589' ' ' ILE . . . . . . . . . . . . . 48.5 mm -79.99 -35.87 16.4 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.89 -1.924 . . . . 1.97 109.806 -175.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -57.56 -50.01 74.5 Favored 'General case' 0 C--O 1.221 -0.438 0 N-CA-C 107.756 -1.201 . . . . 2.6200000000000001 107.756 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . 0.559 HD12 HG22 ' B' ' 566' ' ' VAL . 37.1 pt -63.74 -43.72 98.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.688 -0.687 . . . . 1.96 112.802 -177.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . 0.491 ' N ' HG13 ' B' ' 591' ' ' ILE . . . -63.96 -39.13 93.43 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.494 -0.482 . . . . 0.0 112.261 177.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -62.41 -70.02 0.22 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 119.096 -1.041 . . . . 2.3599999999999999 109.807 174.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -56.12 -23.82 36.72 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 116.587 2.069 . . . . 2.1899999999999999 116.587 -176.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.3 p -121.61 25.14 9.47 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 114.247 1.203 . . . . 1.26 114.247 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 596' ' ' ARG . . . . . 0.423 ' HE ' ' HA ' ' B' ' 596' ' ' ARG . 0.0 OUTLIER -48.5 -38.6 20.57 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.824 1.787 . . . . 3.5800000000000001 115.824 -172.404 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . 0.424 ' O ' HG12 ' B' ' 600' ' ' VAL . 24.1 tpp180 -69.48 -32.62 71.62 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.214 0.82 . . . . 3.7400000000000002 113.214 -175.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 598' ' ' HIS . . . . . 0.597 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 57.5 m-70 -70.15 -3.9 18.93 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.619 -0.719 . . . . 2.1400000000000001 112.05 -173.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 599' ' ' PHE . . . . . 0.532 ' HE1' HD21 ' B' ' 562' ' ' LEU . 6.1 m-85 -105.51 -16.96 14.57 Favored 'General case' 0 CA--C 1.516 -0.329 0 O-C-N 123.669 0.606 . . . . 2.9500000000000002 110.268 -176.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . 0.424 HG12 ' O ' ' B' ' 597' ' ' ARG . 9.3 p -105.84 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.039 -0.982 . . . . 1.4199999999999999 111.325 -175.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -101.95 139.53 37.46 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.547 -0.861 . . . . 2.3399999999999999 111.601 176.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 5.7 p -60.91 122.76 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.489 0 N-CA-C 108.577 -0.898 . . . . 1.3700000000000001 108.577 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -92.83 167.34 11.91 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 123.705 0.628 . . . . 2.6800000000000002 110.051 -177.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 17.3 m -71.93 128.96 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 N-CA-C 112.981 0.734 . . . . 1.27 112.981 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.38 6.51 64.4 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.082 -175.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -131.55 158.04 42.0 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.555 -0.858 . . . . 2.5099999999999998 110.766 175.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 31.5 m -103.24 -22.56 4.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.093 -0.958 . . . . 1.3999999999999999 112.507 -175.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 608' ' ' MET . . . . . 0.46 ' HG3' ' HD2' ' B' ' 609' ' ' PRO . 59.6 ttp -136.99 142.26 37.79 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.643 0.609 . . . . 2.6800000000000002 112.643 -174.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 609' ' ' PRO . . . . . 0.46 ' HD2' ' HG3' ' B' ' 608' ' ' MET . 68.9 Cg_exo -52.09 130.92 37.03 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 120.928 1.085 . . . . 0.42999999999999999 112.094 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -57.01 -31.86 65.54 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 111.792 0.293 . . . . 2.3700000000000001 111.792 -174.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 611' ' ' ILE . . . . . 0.419 HG23 ' N ' ' B' ' 612' ' ' ASP . 14.0 tt -50.06 -44.75 22.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.814 0.34 . . . . 1.8400000000000001 110.592 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 612' ' ' ASP . . . . . 0.419 ' N ' HG23 ' B' ' 611' ' ' ILE . 20.8 m-20 -49.92 -52.11 35.7 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.632 0.773 . . . . 2.1499999999999999 112.854 177.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -59.84 -37.14 78.39 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.612 -0.435 . . . . 2.6600000000000001 110.21 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 41.6 mm -64.49 -48.04 86.71 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 120.169 -0.612 . . . . 1.76 111.946 178.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 63.5 tp -62.57 -31.13 71.88 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 113.012 0.745 . . . . 1.8400000000000001 113.012 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -79.55 2.1 23.46 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.569 1.322 . . . . 2.0600000000000001 114.569 -179.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 36.5 p30 -142.42 15.59 2.02 Favored 'General case' 0 C--O 1.242 0.685 0 N-CA-C 113.143 0.794 . . . . 1.97 113.143 -174.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 618' ' ' ILE . . . . . 0.453 HG23 ' N ' ' B' ' 619' ' ' ASN . 10.7 tt -46.9 -46.99 8.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 C-N-CA 118.911 -1.115 . . . . 2.0099999999999998 110.222 -176.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 619' ' ' ASN . . . . . 0.453 ' N ' HG23 ' B' ' 618' ' ' ILE . 45.4 t-20 -63.23 -51.06 67.76 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 113.754 1.02 . . . . 2.2799999999999998 113.754 -176.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 73.3 p -56.89 -31.88 65.31 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 119.455 -0.898 . . . . 1.3200000000000001 110.782 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 621' ' ' ILE . . . . . 0.456 HG23 ' HD1' ' B' ' 570' ' ' PHE . 17.7 mt -79.33 -42.64 23.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 115.334 1.605 . . . . 2.0 115.334 -179.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 622' ' ' ILE . . . . . 0.67 ' HA ' HD23 ' B' ' 625' ' ' LEU . 14.3 mt -87.69 -6.22 10.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.055 1.502 . . . . 2.0899999999999999 115.055 -177.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 44.1 t -20.0 -58.34 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 116.529 2.048 . . . . 1.47 116.529 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -99.21 -7.58 26.3 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.977 -1.465 . . . . 2.0699999999999998 111.027 -163.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 625' ' ' LEU . . . . . 0.842 HD21 ' HB3' ' B' ' 573' ' ' MET . 3.6 mm? -71.97 146.86 47.47 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.443 -0.344 . . . . 1.6699999999999999 111.689 -173.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 626' ' ' GLN . . . . . 0.642 ' O ' HG23 ' B' ' 630' ' ' VAL . 47.5 mt-30 -76.68 162.0 72.13 Favored Pre-proline 0 CA--C 1.519 -0.241 0 N-CA-C 108.834 -0.802 . . . . 2.3500000000000001 108.834 174.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 627' ' ' PRO . . . . . 0.558 ' HD2' ' HB3' ' B' ' 626' ' ' GLN . 5.4 Cg_endo -47.71 -43.67 28.12 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 N-CA-C 115.825 1.433 . . . . 0.44 115.825 -178.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -67.31 -43.07 82.56 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.563 -0.532 . . . . 2.6200000000000001 109.563 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -63.26 -38.29 90.57 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.946 -0.57 . . . . 2.0600000000000001 110.926 178.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 630' ' ' VAL . . . . . 0.642 HG23 ' O ' ' B' ' 626' ' ' GLN . 38.6 t . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.316 -0.85 . . . . 1.3 110.695 176.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 112.445 -0.262 . . . . 9.8599999999999994 112.445 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.8 m 58.17 -167.82 0.14 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.812 0.339 . . . . 8.7799999999999994 111.032 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.95 -170.09 2.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.233 -0.439 . . . . 6.8200000000000003 111.026 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.2 t -163.94 24.42 0.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 6.25 110.625 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -98.4 17.29 58.72 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.782 -0.723 . . . . 4.1200000000000001 112.45 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -143.81 -26.06 0.55 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.761 0.315 . . . . 4.0300000000000002 110.947 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.59 HD12 HD11 ' A' ' 10' ' ' LEU . 20.4 tp -73.4 -16.4 61.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 2.21 110.82 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -80.69 -40.2 25.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.25 -0.432 . . . . 3.79 111.545 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.51 -50.07 71.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.418 -0.355 . . . . 4.1699999999999999 111.507 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.59 HD11 HD12 ' A' ' 7' ' ' LEU . 2.1 pp -66.55 -9.9 39.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.436 -0.347 . . . . 2.5800000000000001 111.349 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.27 -13.92 59.65 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.85 0.357 . . . . 2.8399999999999999 111.215 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 18.5 tp -67.39 -10.28 49.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 3.6699999999999999 110.947 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -77.38 -39.68 46.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.096 -0.502 . . . . 4.9299999999999997 111.509 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.556 HD12 ' HB ' ' B' ' 564' ' ' THR . 2.3 tm? -58.17 -35.27 71.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.462 -0.336 . . . . 3.27 110.826 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.92 -13.33 10.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.341 -0.39 . . . . 3.1299999999999999 111.4 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -113.85 105.43 1.6 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.775 -0.726 . . . . 2.4700000000000002 112.707 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 tt -166.72 118.34 0.96 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.803 0.335 . . . . 2.1400000000000001 110.381 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -152.19 140.93 20.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.239 -0.437 . . . . 3.9199999999999999 111.045 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.456 ' HA ' ' HB3' ' B' ' 537' ' ' LYS . 4.5 mp -91.67 -17.58 7.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.069 -0.514 . . . . 3.25 110.857 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.417 ' HB2' ' HE1' ' B' ' 577' ' ' HIS . 36.6 t30 -143.88 102.74 3.95 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.365 -0.379 . . . . 5.9500000000000002 111.179 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -172.96 140.98 0.95 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.292 -0.413 . . . . 9.3900000000000006 110.797 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 64.3 p -92.33 42.58 1.11 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.985 0.422 . . . . 8.9700000000000006 111.176 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -103.39 103.61 13.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 11.67 110.856 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -157.04 101.0 0.2 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.919 -0.658 . . . . 12.859999999999999 112.46 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -146.26 -167.76 2.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.836 0.35 . . . . 15.369999999999999 111.208 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -63.87 122.77 17.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.267 -0.424 . . . . 16.539999999999999 110.867 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 51.7 t . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.297 -0.859 . . . . 17.93 110.91 -179.76 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 504' ' ' ILE . . . . . 0.861 HG12 ' HB3' ' B' ' 507' ' ' ALA . 14.5 tt . . . . . 0 C--O 1.236 0.371 0 N-CA-C 113.098 0.777 . . . . 2.1299999999999999 113.098 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 48.1 m -48.85 119.2 3.01 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.6 0.592 . . . . 1.29 112.6 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.85 1.45 67.75 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 120.946 -0.645 . . . . 0.0 114.408 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 507' ' ' ALA . . . . . 0.861 ' HB3' HG12 ' B' ' 504' ' ' ILE . . . -94.34 -7.59 41.31 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 117.646 0.723 . . . . 0.02 112.443 176.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 25.8 mmt -112.4 160.06 18.1 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 121.116 0.484 . . . . 2.21 112.283 174.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -69.76 134.26 48.38 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.085 -0.709 . . . . 2.6699999999999999 109.085 174.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 510' ' ' GLU . . . . . 0.606 ' HB2' HH21 ' B' ' 553' ' ' ARG . 39.7 tt0 -41.68 -35.47 0.78 Allowed 'General case' 0 C--O 1.24 0.598 0 N-CA-C 113.394 0.887 . . . . 2.6600000000000001 113.394 -173.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -73.73 -41.94 61.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.515 -0.766 . . . . 2.4399999999999999 112.117 -176.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -64.79 -40.16 94.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.178 0.513 . . . . 2.0800000000000001 110.878 171.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . 0.476 ' O ' HD13 ' B' ' 517' ' ' LEU . 45.0 tt0 -53.76 -48.62 69.56 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.344 -0.843 . . . . 1.9199999999999999 111.091 177.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 514' ' ' LYS . . . . . 0.416 ' O ' HG13 ' B' ' 518' ' ' VAL . 24.8 ttpp -54.9 -57.59 11.02 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 111.911 0.337 . . . . 2.73 111.911 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . 0.466 ' O ' HG22 ' B' ' 518' ' ' VAL . 37.1 ttm180 -56.6 -35.89 68.77 Favored 'General case' 0 CA--C 1.506 -0.733 0 O-C-N 124.209 0.943 . . . . 3.75 111.127 -177.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.498 ' O ' HG23 ' B' ' 520' ' ' VAL . 73.8 t80 -76.11 -45.58 33.11 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.065 -0.971 . . . . 1.8899999999999999 110.515 -173.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 517' ' ' LEU . . . . . 0.638 HD21 ' CG ' ' B' ' 551' ' ' TYR . 8.7 mp -66.73 -32.25 73.42 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.755 -0.657 . . . . 1.8999999999999999 112.642 177.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 518' ' ' VAL . . . . . 0.466 HG22 ' O ' ' B' ' 515' ' ' ARG . 28.3 m -67.49 -35.1 72.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 118.535 -1.266 . . . . 1.3999999999999999 109.07 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 519' ' ' THR . . . . . . . . . . . . . 20.7 p -72.99 -36.31 67.03 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.393 0.616 . . . . 1.1799999999999999 112.408 178.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 520' ' ' VAL . . . . . 0.498 HG23 ' O ' ' B' ' 516' ' ' PHE . 54.5 t -71.23 -42.29 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 122.133 -0.354 . . . . 1.22 111.703 -174.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 521' ' ' ILE . . . . . 0.515 ' O ' HD13 ' B' ' 525' ' ' LEU . 2.3 pp -90.68 -25.83 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 N-CA-C 115.442 1.645 . . . . 1.98 115.442 -175.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 6.1 tmmm? -60.75 -35.24 75.89 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.712 -0.847 . . . . 2.5699999999999998 108.712 173.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -92.42 -21.53 20.15 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.979 1.474 . . . . 2.1699999999999999 114.979 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 38.4 mt -70.58 -45.43 65.37 Favored 'General case' 0 C--O 1.218 -0.588 0 N-CA-C 109.313 -0.625 . . . . 1.48 109.313 168.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . 0.635 HD12 HD13 ' B' ' 544' ' ' ILE . 7.5 mp -52.19 -45.43 65.15 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.197 0.522 . . . . 1.95 110.978 169.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . 0.455 ' O ' ' HG2' ' B' ' 529' ' ' GLU . . . -66.51 -40.63 94.33 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 -178.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 47.0 mt -63.52 -36.07 82.57 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.038 0.447 . . . . 1.6699999999999999 111.47 175.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 528' ' ' CYS . . . . . 0.518 ' HB2' HG21 ' B' ' 540' ' ' ILE . 49.5 t -63.54 -47.7 80.55 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.08 -0.509 . . . . 0.58999999999999997 110.662 -175.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 529' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' B' ' 526' ' ' GLY . 13.0 pt-20 -61.8 -29.58 70.25 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.44 -0.8 . . . . 2.5 112.542 173.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -71.68 -54.64 9.67 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.376 0.88 . . . . 2.2400000000000002 113.376 -177.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 531' ' ' LYS . . . . . 0.46 ' O ' ' HD2' ' B' ' 537' ' ' LYS . 67.6 mttm -68.8 137.95 54.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.964 -0.562 . . . . 2.2799999999999998 111.119 -177.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -96.46 160.7 14.27 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.811 -0.631 . . . . 4.21 110.231 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.5 119.57 1.36 Allowed Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 115.905 -0.589 . . . . 0.0 114.019 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 534' ' ' LYS . . . . . 0.462 ' HD3' ' N ' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.11 -36.65 8.61 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.176 0.806 . . . . 2.9500000000000002 113.176 177.274 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -50.51 -51.92 43.22 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.382 -0.527 . . . . 2.2000000000000002 110.828 174.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 536' ' ' ASN . . . . . 0.479 ' O ' HD13 ' B' ' 540' ' ' ILE . 14.0 m120 -65.98 -44.85 83.66 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.697 0.628 . . . . 1.47 112.697 178.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 537' ' ' LYS . . . . . 0.46 ' HD2' ' O ' ' B' ' 531' ' ' LYS . 0.0 OUTLIER -67.78 -31.97 72.23 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.375 -0.53 . . . . 2.5 110.368 -174.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.2 -46.95 69.21 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.79 -0.641 . . . . 0.040000000000000001 111.079 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 85.9 mt -58.1 -54.98 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.558 0.694 . . . . 1.8200000000000001 111.295 173.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 540' ' ' ILE . . . . . 0.518 HG21 ' HB2' ' B' ' 528' ' ' CYS . 1.7 mp -56.82 -48.04 81.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.719 -0.613 . . . . 1.8500000000000001 110.632 -178.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 541' ' ' ALA . . . . . 0.5 ' O ' ' HG2' ' B' ' 545' ' ' MET . . . -57.44 -44.21 84.55 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 113.514 0.931 . . . . 0.02 113.514 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 90.7 p -60.36 -38.78 84.94 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.601 -0.44 . . . . 1.2 110.271 -178.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 543' ' ' ASN . . . . . 0.442 ' O ' HG12 ' B' ' 547' ' ' ILE . 3.1 t-20 -69.06 -47.06 66.28 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 114.362 1.245 . . . . 2.0299999999999998 114.362 -175.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 544' ' ' ILE . . . . . 0.635 HD13 HD12 ' B' ' 525' ' ' LEU . 23.1 mt -52.66 -45.89 48.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.539 -0.912 . . . . 1.8100000000000001 108.539 170.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 545' ' ' MET . . . . . 0.779 ' HB3' HG21 ' B' ' 587' ' ' THR . 33.4 mmt -64.05 -42.33 97.07 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 119.659 -0.816 . . . . 2.6000000000000001 112.833 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -58.28 -48.77 79.41 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 119.189 -1.004 . . . . 2.0800000000000001 109.893 176.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 547' ' ' ILE . . . . . 0.442 HG12 ' O ' ' B' ' 543' ' ' ASN . 43.3 mm -55.06 -61.48 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.77 0.656 . . . . 1.5 112.77 179.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 548' ' ' VAL . . . . . 0.718 HG13 HD11 ' B' ' 555' ' ' LEU . 97.9 t -47.3 -44.27 8.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 119.817 -0.753 . . . . 1.3999999999999999 111.427 176.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.02 58.81 Favored Glycine 0 C--N 1.332 0.332 0 O-C-N 121.791 -0.568 . . . . 0.0 112.934 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -87.05 -9.55 55.21 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.629 0.604 . . . . 2.27 112.629 -175.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 551' ' ' TYR . . . . . 0.638 ' CG ' HD21 ' B' ' 517' ' ' LEU . 84.7 m-85 -120.45 59.69 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.798 1.036 . . . . 3.5299999999999998 113.798 -176.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -55.97 -39.36 91.65 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 O-C-N 122.183 0.57 . . . . 0.46000000000000002 113.162 177.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 553' ' ' ARG . . . . . 0.606 HH21 ' HB2' ' B' ' 510' ' ' GLU . 11.2 ptm180 -56.33 -46.72 79.77 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 121.147 0.499 . . . . 3.8700000000000001 109.935 -174.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -48.96 -59.72 3.37 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.927 0.891 . . . . 0.69999999999999996 112.12 167.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 555' ' ' LEU . . . . . 0.718 HD11 HG13 ' B' ' 548' ' ' VAL . 11.1 mp -54.39 -48.49 71.49 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 116.305 -0.407 . . . . 1.49 110.177 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -53.94 -35.88 62.19 Favored 'General case' 0 C--O 1.242 0.682 0 N-CA-C 113.791 1.034 . . . . 3.0899999999999999 113.791 -178.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.1 -12.16 50.78 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.458 -0.497 . . . . 0.0 112.047 -177.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 17.4 t-160 -128.26 78.51 1.84 Allowed 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.456 1.28 . . . . 2.9300000000000002 114.456 -177.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 6.1 m-90 -50.48 -48.26 56.76 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 116.584 2.068 . . . . 3.1099999999999999 116.584 -176.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 560' ' ' LYS . . . . . 0.426 ' O ' HG23 ' B' ' 564' ' ' THR . 4.7 tppp? -56.71 -36.65 69.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.325 -0.398 . . . . 3.3199999999999998 111.099 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 561' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -74.84 -45.14 45.21 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 119.095 -1.042 . . . . 1.25 111.916 175.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . 0.557 ' O ' HG12 ' B' ' 565' ' ' VAL . 6.3 tt -49.99 -59.15 4.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.529 0.332 . . . . 1.3200000000000001 110.226 175.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 563' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -50.21 -38.54 40.71 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.912 1.079 . . . . 2.7400000000000002 113.912 178.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 564' ' ' THR . . . . . 0.556 ' HB ' HD12 ' A' ' 14' ' ' LEU . 24.0 p -71.92 -39.31 69.56 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.498 0.666 . . . . 1.24 110.371 -176.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 565' ' ' VAL . . . . . 0.689 HG21 HG11 ' B' ' 548' ' ' VAL . 0.3 OUTLIER -62.83 -41.24 91.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.676 -0.693 . . . . 1.1899999999999999 112.543 173.361 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 566' ' ' VAL . . . . . . . . . . . . . 85.2 t -71.11 -50.83 39.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 C-N-CA 120.519 -0.473 . . . . 1.3600000000000001 110.845 -176.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 15.1 m-80 -51.09 -37.42 45.63 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.965 -0.562 . . . . 1.9399999999999999 112.01 170.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 568' ' ' LYS . . . . . . . . . . . . . 36.1 mmtm -72.58 -32.76 66.26 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.701 -0.481 . . . . 3.5299999999999998 109.701 -179.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 569' ' ' LEU . . . . . 0.432 HD13 ' O ' ' B' ' 565' ' ' VAL . 4.3 mp -67.45 -36.51 81.34 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 108.737 -0.838 . . . . 2.0099999999999998 108.737 177.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 570' ' ' PHE . . . . . 0.602 ' HA ' HD11 ' B' ' 621' ' ' ILE . 18.2 m-30 -65.29 -39.35 92.41 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.915 -0.402 . . . . 3.77 109.915 178.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.448 ' O ' ' ND1' ' B' ' 574' ' ' HIS . 36.8 tt0 -57.74 -53.44 58.16 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 119.921 -0.711 . . . . 2.4700000000000002 110.508 176.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -62.43 -10.0 10.15 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.11 1.152 . . . . 1.23 114.11 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 573' ' ' MET . . . . . 0.5 ' HB3' HD21 ' B' ' 625' ' ' LEU . 54.9 mtt -76.4 -5.31 46.73 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.703 0.763 . . . . 2.1099999999999999 109.646 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 574' ' ' HIS . . . . . 0.448 ' ND1' ' O ' ' B' ' 571' ' ' GLU . 0.0 OUTLIER -109.48 -0.51 18.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.729 -1.123 . . . . 3.2000000000000002 111.434 173.792 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 575' ' ' GLU . . . . . 0.411 ' HG2' HG11 ' B' ' 580' ' ' VAL . 9.7 tp10 -68.51 130.18 42.11 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 116.217 -0.447 . . . . 1.55 110.094 177.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 3.9 t -87.79 -21.31 25.18 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.984 0.735 . . . . 1.3999999999999999 112.984 -177.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 577' ' ' HIS . . . . . 0.417 ' HE1' ' HB2' ' A' ' 20' ' ' ASN . 30.2 m80 -60.11 128.03 34.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.385 0.612 . . . . 2.8500000000000001 112.597 -175.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -44.92 125.84 5.39 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.372 -0.831 . . . . 2.1499999999999999 113.132 -171.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.3 -34.74 4.77 Favored Glycine 0 C--O 1.223 -0.55 0 N-CA-C 116.203 1.241 . . . . 0.0 116.203 174.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 580' ' ' VAL . . . . . 0.411 HG11 ' HG2' ' B' ' 575' ' ' GLU . 47.5 t -53.67 -46.36 61.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.195 0.813 . . . . 1.29 113.195 -175.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 22.2 pt20 -59.72 -42.22 92.6 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.406 0.521 . . . . 1.99 112.406 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.54 -42.43 96.52 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.155 0.428 . . . . 2.23 112.155 172.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 90.8 mmm -60.72 -49.46 77.41 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.069 -0.252 . . . . 2.5800000000000001 110.43 175.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.78 -43.0 80.41 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.154 -0.475 . . . . 0.029999999999999999 111.664 -177.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 585' ' ' CYS . . . . . 0.434 ' O ' HG12 ' B' ' 589' ' ' ILE . 52.7 t -74.38 -40.99 61.72 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 120.042 -0.663 . . . . 1.5 111.912 -177.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -59.58 -46.34 89.21 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.316 -0.402 . . . . 1.98 111.95 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 587' ' ' THR . . . . . 0.779 HG21 ' HB3' ' B' ' 545' ' ' MET . 36.4 p -62.15 -41.26 98.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.322 0.649 . . . . 1.3 110.366 175.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -61.41 -32.25 72.19 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.147 -0.478 . . . . 0.53000000000000003 111.129 -177.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 589' ' ' ILE . . . . . 0.434 HG12 ' O ' ' B' ' 585' ' ' CYS . 50.3 mm -79.88 -36.02 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 C-N-CA 116.902 -1.919 . . . . 1.97 109.775 -175.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . 0.403 ' NZ ' ' HA ' ' B' ' 587' ' ' THR . 36.8 mtmm -57.4 -50.01 74.35 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 107.75 -1.204 . . . . 2.6200000000000001 107.75 176.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 83.9 mt -63.84 -43.76 97.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.697 -0.683 . . . . 1.96 112.726 -176.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.96 -39.1 93.37 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.425 -0.51 . . . . 0.0 112.285 177.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -62.38 -70.04 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 119.096 -1.041 . . . . 2.3599999999999999 109.815 174.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -56.16 -23.72 36.66 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 116.596 2.073 . . . . 2.1899999999999999 116.596 -176.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 82.8 m -121.71 25.14 9.42 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 114.241 1.2 . . . . 1.26 114.241 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -48.52 -38.47 20.4 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.835 1.791 . . . . 3.5800000000000001 115.835 -172.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -69.7 -32.54 71.19 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.212 0.819 . . . . 3.7400000000000002 113.212 -175.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 55.3 m80 -70.16 -3.77 18.36 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.593 -0.731 . . . . 2.1400000000000001 112.08 -173.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 599' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -105.53 -17.01 14.55 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.564 0.54 . . . . 2.9500000000000002 110.241 -176.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 21.6 t -105.82 -24.37 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.025 -0.989 . . . . 1.4199999999999999 111.327 -175.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -101.97 139.49 37.53 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 119.566 -0.854 . . . . 2.3399999999999999 111.576 176.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 11.8 m -60.85 122.69 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.671 -0.863 . . . . 1.3700000000000001 108.671 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -92.75 167.3 11.97 Favored 'General case' 0 C--O 1.225 -0.213 0 O-C-N 123.659 0.599 . . . . 2.6800000000000002 110.111 -177.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 34.9 t -71.94 128.96 35.47 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 N-CA-C 112.949 0.722 . . . . 1.27 112.949 -175.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.33 6.59 64.42 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.11 -175.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 606' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -131.53 157.99 42.12 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.565 -0.854 . . . . 2.5099999999999998 110.745 175.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 29.2 t -103.2 -22.62 4.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.029 -0.987 . . . . 1.3999999999999999 112.496 -175.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 608' ' ' MET . . . . . . . . . . . . . 66.0 mtm -136.91 142.25 37.87 Favored Pre-proline 0 C--O 1.223 -0.302 0 N-CA-C 112.626 0.602 . . . . 2.6800000000000002 112.626 -174.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 609' ' ' PRO . . . . . 0.543 ' HB2' HG22 ' B' ' 611' ' ' ILE . 9.6 Cg_endo -52.08 130.88 36.85 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.845 1.03 . . . . 0.42999999999999999 112.131 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -57.02 -31.79 65.49 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.826 0.306 . . . . 2.3700000000000001 111.826 -174.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 611' ' ' ILE . . . . . 0.543 HG22 ' HB2' ' B' ' 609' ' ' PRO . 5.9 tp -50.1 -44.74 22.71 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 120.782 0.325 . . . . 1.8400000000000001 110.577 178.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 612' ' ' ASP . . . . . 0.411 ' N ' HG23 ' B' ' 611' ' ' ILE . 16.7 t70 -49.9 -52.12 35.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.632 0.773 . . . . 2.1499999999999999 112.855 177.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 613' ' ' GLU . . . . . 0.553 ' HA ' ' ND2' ' B' ' 616' ' ' ASN . 45.7 mt-10 -59.86 -37.03 78.16 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 120.512 -0.475 . . . . 2.6600000000000001 110.231 179.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 62.1 mt -64.58 -48.03 86.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 120.149 -0.62 . . . . 1.76 111.907 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 615' ' ' LEU . . . . . . . . . . . . . 81.8 mt -62.63 -31.13 71.93 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.959 0.725 . . . . 1.8400000000000001 112.959 -177.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 616' ' ' ASN . . . . . 0.553 ' ND2' ' HA ' ' B' ' 613' ' ' GLU . 20.6 p30 -79.57 2.15 23.33 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.559 1.318 . . . . 2.0600000000000001 114.559 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -142.43 15.67 2.02 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 113.114 0.783 . . . . 1.97 113.114 -174.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 618' ' ' ILE . . . . . 0.542 ' O ' HG22 ' B' ' 621' ' ' ILE . 5.0 tp -46.95 -47.01 8.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 C-N-CA 118.973 -1.091 . . . . 2.0099999999999998 110.135 -176.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 619' ' ' ASN . . . . . 0.426 ' N ' HG23 ' B' ' 618' ' ' ILE . 41.5 t-20 -63.23 -51.07 67.72 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 113.749 1.018 . . . . 2.2799999999999998 113.749 -176.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 72.6 p -56.9 -31.93 65.39 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.455 -0.898 . . . . 1.3200000000000001 110.737 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 621' ' ' ILE . . . . . 0.602 HD11 ' HA ' ' B' ' 570' ' ' PHE . 0.4 OUTLIER -79.32 -42.54 23.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 N-CA-C 115.362 1.615 . . . . 2.0 115.362 -178.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 622' ' ' ILE . . . . . 0.409 HG12 ' O ' ' B' ' 618' ' ' ILE . 37.6 pt -87.73 -6.27 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.037 1.495 . . . . 2.0899999999999999 115.037 -177.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 54.0 t -19.9 -58.33 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 116.642 2.09 . . . . 1.47 116.642 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -99.29 -7.56 26.18 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.028 -1.442 . . . . 2.0699999999999998 110.989 -163.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 625' ' ' LEU . . . . . 0.5 HD21 ' HB3' ' B' ' 573' ' ' MET . 93.7 mt -71.94 146.93 47.46 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.295 0.372 . . . . 1.6699999999999999 111.694 -173.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 626' ' ' GLN . . . . . 0.714 ' O ' HG13 ' B' ' 630' ' ' VAL . 17.3 mp0 -76.74 162.1 71.65 Favored Pre-proline 0 N--CA 1.463 0.189 0 N-CA-C 108.776 -0.824 . . . . 2.3500000000000001 108.776 174.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 627' ' ' PRO . . . . . 0.757 ' O ' HG22 ' B' ' 630' ' ' VAL . 79.4 Cg_exo -47.81 -43.56 28.89 Favored 'Trans proline' 0 CA--C 1.529 0.243 0 N-CA-C 115.856 1.445 . . . . 0.44 115.856 -178.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -67.36 -43.02 82.47 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.608 -0.516 . . . . 2.6200000000000001 109.608 -174.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 629' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -63.28 -38.33 90.72 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.929 -0.578 . . . . 2.0600000000000001 110.831 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 630' ' ' VAL . . . . . 0.757 HG22 ' O ' ' B' ' 627' ' ' PRO . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.353 -0.832 . . . . 1.3 110.661 176.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.163 0 N-CA-C 112.429 -0.269 . . . . 9.8599999999999994 112.429 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.3 t 58.28 21.62 8.4 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.076 0.465 . . . . 8.7799999999999994 110.783 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -76.2 -27.47 56.89 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.921 -0.581 . . . . 6.8200000000000003 111.081 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.2 t -167.47 -74.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 6.25 110.848 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 76.96 37.3 33.5 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.617 -0.801 . . . . 4.1200000000000001 112.505 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.443 ' O ' ' HG2' ' A' ' 9' ' ' GLU . 18.9 m120 -148.97 -28.36 0.28 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.984 0.421 . . . . 4.0300000000000002 110.456 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.466 ' HG ' HD12 ' A' ' 10' ' ' LEU . 4.8 tt -81.24 -14.85 57.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.906 -0.588 . . . . 2.21 111.356 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -61.65 -35.69 78.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.406 -0.361 . . . . 3.79 111.852 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 6' ' ' ASN . 12.2 pt-20 -73.94 -24.28 59.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.682 0.277 . . . . 4.1699999999999999 111.355 -179.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.466 HD12 ' HG ' ' A' ' 7' ' ' LEU . 25.0 mt -67.49 -21.06 65.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.403 -0.362 . . . . 2.5800000000000001 111.086 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.23 -35.88 35.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 2.8399999999999999 111.806 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 48.2 tp -60.5 -30.21 69.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.417 -0.356 . . . . 3.6699999999999999 111.163 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.45 ' O ' HD11 ' B' ' 525' ' ' LEU . 1.4 mptm? -76.62 -34.08 58.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 4.9299999999999997 111.465 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.633 HD12 HG22 ' B' ' 564' ' ' THR . 2.6 tm? -59.36 -44.34 92.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.505 -0.316 . . . . 3.27 110.831 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.02 -9.5 4.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.311 -0.404 . . . . 3.1299999999999999 111.536 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -101.24 49.83 1.03 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.813 -0.708 . . . . 2.4700000000000002 112.719 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.538 HD12 ' HZ ' ' B' ' 572' ' ' PHE . 0.2 OUTLIER -117.41 105.5 12.2 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 110.245 -0.28 . . . . 2.1400000000000001 110.245 -179.986 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -129.22 134.78 48.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.885 0.374 . . . . 3.9199999999999999 111.21 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.555 HG23 ' HB2' ' B' ' 537' ' ' LYS . 75.5 mt -90.32 -29.1 4.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 3.25 110.857 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 60.7 m-20 -62.53 -74.08 0.1 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.199 -0.455 . . . . 5.9500000000000002 111.057 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -171.01 -158.19 0.14 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 9.3900000000000006 110.902 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.1 m 66.65 125.89 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.052 0.453 . . . . 8.9700000000000006 111.333 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -145.32 160.8 40.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.98 -0.554 . . . . 11.67 110.697 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -138.25 103.21 0.4 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.623 -0.799 . . . . 12.859999999999999 112.588 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -123.28 121.72 36.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.653 0.263 . . . . 15.369999999999999 110.823 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -101.56 139.64 36.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.328 -0.396 . . . . 16.539999999999999 111.003 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 82.3 m . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.158 -0.925 . . . . 17.93 110.707 179.86 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 504' ' ' ILE . . . . . 0.937 HG13 ' HB3' ' B' ' 507' ' ' ALA . 7.6 tp . . . . . 0 C--O 1.235 0.309 0 N-CA-C 113.076 0.769 . . . . 2.1299999999999999 113.076 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 80.0 p -48.91 119.12 2.97 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.53 0.567 . . . . 1.29 112.53 174.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.9 1.39 67.67 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 120.964 -0.636 . . . . 0.0 114.37 -179.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 507' ' ' ALA . . . . . 0.937 ' HB3' HG13 ' B' ' 504' ' ' ILE . . . -94.29 -7.56 41.57 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 117.736 0.768 . . . . 0.02 112.405 176.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -112.49 160.02 18.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.191 0.519 . . . . 2.21 112.186 174.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -69.78 134.14 48.23 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.131 -0.692 . . . . 2.6699999999999999 109.131 174.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -41.57 -35.46 0.73 Allowed 'General case' 0 C--O 1.24 0.567 0 N-CA-C 113.421 0.897 . . . . 2.6600000000000001 113.421 -173.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.78 -41.96 61.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.505 -0.771 . . . . 2.4399999999999999 112.082 -176.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.87 -40.04 94.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.133 0.492 . . . . 2.0800000000000001 110.893 171.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -53.66 -48.76 69.12 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.387 -0.824 . . . . 1.9199999999999999 111.102 177.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 514' ' ' LYS . . . . . 0.46 ' O ' HG23 ' B' ' 518' ' ' VAL . 7.3 mtpm? -54.77 -57.67 10.62 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 111.869 0.322 . . . . 2.73 111.869 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . 0.403 ' O ' HG23 ' B' ' 519' ' ' THR . 61.3 ttp180 -56.59 -35.96 68.82 Favored 'General case' 0 CA--C 1.504 -0.792 0 O-C-N 124.173 0.921 . . . . 3.75 111.086 -177.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.571 ' O ' HG23 ' B' ' 520' ' ' VAL . 62.5 t80 -76.09 -45.6 33.16 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.159 -0.928 . . . . 1.8899999999999999 110.514 -173.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 517' ' ' LEU . . . . . 0.417 ' O ' HG22 ' B' ' 521' ' ' ILE . 13.7 tp -66.74 -32.25 73.43 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.731 -0.668 . . . . 1.8999999999999999 112.615 177.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 518' ' ' VAL . . . . . 0.515 ' O ' ' HB2' ' B' ' 522' ' ' LYS . 69.3 t -67.5 -35.13 72.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 118.58 -1.248 . . . . 1.3999999999999999 109.081 178.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 519' ' ' THR . . . . . 0.403 HG23 ' O ' ' B' ' 515' ' ' ARG . 74.1 p -72.94 -36.37 67.19 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.369 0.604 . . . . 1.1799999999999999 112.413 178.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 520' ' ' VAL . . . . . 0.571 HG23 ' O ' ' B' ' 516' ' ' PHE . 67.0 t -71.14 -42.45 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 116.46 -0.336 . . . . 1.22 111.638 -174.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 521' ' ' ILE . . . . . 0.417 HG22 ' O ' ' B' ' 517' ' ' LEU . 17.6 tt -90.65 -25.78 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 115.406 1.632 . . . . 1.98 115.406 -175.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 522' ' ' LYS . . . . . 0.515 ' HB2' ' O ' ' B' ' 518' ' ' VAL . 0.3 OUTLIER -60.92 -35.25 76.2 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.599 -0.889 . . . . 2.5699999999999998 108.599 173.6 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 523' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -92.4 -21.35 20.27 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.062 1.504 . . . . 2.1699999999999999 115.062 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 68.5 mt -70.64 -45.38 65.26 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 109.3 -0.63 . . . . 1.48 109.3 168.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . 0.471 HD12 HD23 ' A' ' 17' ' ' LEU . 0.6 OUTLIER -52.31 -45.4 65.56 Favored 'General case' 0 C--O 1.246 0.879 0 CA-C-O 121.2 0.524 . . . . 1.95 110.931 169.778 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.55 -40.47 94.22 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 40.2 mt -63.63 -36.14 82.84 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.043 0.449 . . . . 1.6699999999999999 111.426 175.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 528' ' ' CYS . . . . . . . . . . . . . 48.1 t -63.47 -47.74 80.54 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.041 -0.527 . . . . 0.58999999999999997 110.648 -175.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -61.8 -29.52 70.21 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.472 -0.786 . . . . 2.5 112.517 173.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -71.71 -54.65 9.61 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.353 0.872 . . . . 2.2400000000000002 113.353 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 531' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -68.76 137.94 54.44 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.008 -0.542 . . . . 2.2799999999999998 111.07 -177.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 532' ' ' ARG . . . . . 0.438 ' HA ' ' NZ ' ' B' ' 537' ' ' LYS . 35.8 mmt180 -96.44 160.67 14.28 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.774 -0.648 . . . . 4.21 110.183 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.44 119.67 1.36 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.984 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 534' ' ' LYS . . . . . 0.691 ' H ' ' HD2' ' B' ' 534' ' ' LYS . 0.0 OUTLIER -47.18 -36.64 8.92 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.207 0.817 . . . . 2.9500000000000002 113.207 177.245 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -50.5 -51.85 43.66 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.413 -0.515 . . . . 2.2000000000000002 110.828 174.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -66.09 -44.85 83.21 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.62 0.6 . . . . 1.47 112.62 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 537' ' ' LYS . . . . . 0.555 ' HB2' HG23 ' A' ' 19' ' ' ILE . 64.6 mttp -67.87 -31.98 72.16 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.272 -174.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -68.09 -46.99 69.45 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.839 -0.619 . . . . 0.040000000000000001 111.115 178.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 75.8 mt -58.12 -55.03 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 121.569 0.699 . . . . 1.8200000000000001 111.194 173.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 540' ' ' ILE . . . . . . . . . . . . . 94.0 mt -56.81 -48.07 81.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.605 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 541' ' ' ALA . . . . . 0.451 ' O ' HG12 ' B' ' 544' ' ' ILE . . . -57.49 -43.99 84.6 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 113.583 0.957 . . . . 0.02 113.583 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 94.8 p -60.46 -38.86 85.54 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.647 -0.421 . . . . 1.2 110.215 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 543' ' ' ASN . . . . . 0.469 ' O ' HG12 ' B' ' 547' ' ' ILE . 49.5 t30 -69.05 -47.05 66.35 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 114.352 1.241 . . . . 2.0299999999999998 114.352 -175.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 544' ' ' ILE . . . . . 0.476 HG13 ' N ' ' B' ' 545' ' ' MET . 48.9 pt -52.63 -45.94 48.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.492 -0.929 . . . . 1.8100000000000001 108.492 170.032 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 545' ' ' MET . . . . . 0.476 ' N ' HG13 ' B' ' 544' ' ' ILE . 21.4 mmt -64.03 -42.33 97.12 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 119.729 -0.788 . . . . 2.6000000000000001 112.818 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -58.3 -48.78 79.41 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 119.181 -1.007 . . . . 2.0800000000000001 109.887 176.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 547' ' ' ILE . . . . . 0.469 HG12 ' O ' ' B' ' 543' ' ' ASN . 42.0 mm -55.06 -61.38 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.823 0.675 . . . . 1.5 112.823 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 548' ' ' VAL . . . . . 0.445 HG22 ' HA ' ' B' ' 545' ' ' MET . 36.0 m -47.44 -44.23 9.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 C-N-CA 119.854 -0.738 . . . . 1.3999999999999999 111.388 176.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 549' ' ' GLY . . . . . . . . . . . . . . . -57.4 -28.03 58.82 Favored Glycine 0 C--O 1.237 0.336 0 O-C-N 121.791 -0.568 . . . . 0.0 112.917 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 550' ' ' GLN . . . . . 0.569 HE21 ' HA ' ' B' ' 550' ' ' GLN . 0.1 OUTLIER -87.04 -9.58 55.14 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 112.629 0.604 . . . . 2.27 112.629 -175.356 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 551' ' ' TYR . . . . . 0.427 ' O ' HD13 ' B' ' 555' ' ' LEU . 64.4 m-85 -120.38 59.63 6.95 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 113.857 1.058 . . . . 3.5299999999999998 113.857 -176.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 552' ' ' PRO . . . . . 0.568 ' HG3' ' HG2' ' B' ' 594' ' ' LYS . 15.4 Cg_endo -55.99 -39.35 91.72 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 O-C-N 122.122 0.538 . . . . 0.46000000000000002 113.115 178.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 22.0 tpp180 -56.3 -46.81 79.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.134 0.492 . . . . 3.8700000000000001 109.859 -174.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 554' ' ' PHE . . . . . 0.484 ' HD2' HD12 ' B' ' 555' ' ' LEU . 67.8 t80 -48.88 -59.81 3.27 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.935 0.894 . . . . 0.69999999999999996 112.098 168.014 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 555' ' ' LEU . . . . . 0.484 HD12 ' HD2' ' B' ' 554' ' ' PHE . 8.2 mp -54.26 -48.62 70.96 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 116.303 -0.408 . . . . 1.49 110.219 -178.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -53.83 -35.91 61.96 Favored 'General case' 0 C--O 1.242 0.679 0 N-CA-C 113.831 1.049 . . . . 3.0899999999999999 113.831 -178.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.03 -12.25 50.76 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.517 -0.473 . . . . 0.0 112.088 -177.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -128.18 78.5 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 2.9300000000000002 114.388 -177.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 22.0 m-90 -50.52 -48.32 57.18 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 116.534 2.05 . . . . 3.1099999999999999 116.534 -176.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 560' ' ' LYS . . . . . 0.514 ' HA ' ' HE3' ' B' ' 563' ' ' LYS . 37.8 mtmm -56.48 -36.66 69.37 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.324 -0.398 . . . . 3.3199999999999998 111.213 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 561' ' ' PHE . . . . . 0.436 ' O ' HG23 ' B' ' 565' ' ' VAL . 0.7 OUTLIER -74.95 -45.07 44.81 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 119.142 -1.023 . . . . 1.25 111.871 175.613 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . 0.512 ' O ' HG23 ' B' ' 566' ' ' VAL . 3.9 tp -50.01 -59.15 4.17 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.509 0.324 . . . . 1.3200000000000001 110.258 175.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 563' ' ' LYS . . . . . 0.514 ' HE3' ' HA ' ' B' ' 560' ' ' LYS . 19.6 pttp -50.18 -38.66 40.81 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.896 1.073 . . . . 2.7400000000000002 113.896 178.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 564' ' ' THR . . . . . 0.633 HG22 HD12 ' A' ' 14' ' ' LEU . 62.4 m -71.74 -39.39 70.1 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.562 0.696 . . . . 1.24 110.413 -176.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 565' ' ' VAL . . . . . 0.436 HG23 ' O ' ' B' ' 561' ' ' PHE . 92.2 t -62.84 -41.34 92.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.646 -0.706 . . . . 1.1899999999999999 112.527 173.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 566' ' ' VAL . . . . . 0.512 HG23 ' O ' ' B' ' 562' ' ' LEU . 36.2 t -70.93 -50.85 40.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 120.551 -0.46 . . . . 1.3600000000000001 110.924 -176.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 567' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -51.11 -37.38 45.67 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 116.03 -0.532 . . . . 1.9399999999999999 111.987 170.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 568' ' ' LYS . . . . . 0.477 ' HZ3' ' HB2' ' B' ' 568' ' ' LYS . 0.6 OUTLIER -72.72 -32.68 65.89 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.599 -0.519 . . . . 3.5299999999999998 109.599 -179.117 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 569' ' ' LEU . . . . . 0.443 HD23 ' HB2' ' B' ' 588' ' ' PHE . 3.4 mp -67.53 -36.42 80.97 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 108.712 -0.847 . . . . 2.0099999999999998 108.712 177.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 570' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -65.34 -39.39 92.33 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.899 -0.408 . . . . 3.77 109.899 178.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -57.67 -53.46 57.94 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 120.036 -0.665 . . . . 2.4700000000000002 110.521 176.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 572' ' ' PHE . . . . . 0.538 ' HZ ' HD12 ' A' ' 17' ' ' LEU . 42.0 m-85 -62.57 -9.91 10.36 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.018 1.118 . . . . 1.23 114.018 -177.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 573' ' ' MET . . . . . 0.417 ' HG3' ' O ' ' B' ' 569' ' ' LEU . 65.6 mtt -76.36 -5.29 46.56 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-O 121.671 0.748 . . . . 2.1099999999999999 109.7 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -109.43 -0.54 18.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.73 -1.123 . . . . 3.2000000000000002 111.465 173.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 575' ' ' GLU . . . . . 0.542 ' CG ' HG11 ' B' ' 580' ' ' VAL . 7.2 tp10 -68.59 130.28 42.38 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.189 -0.46 . . . . 1.55 110.104 177.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 62.2 p -87.92 -21.27 25.03 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 113.006 0.743 . . . . 1.3999999999999999 113.006 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 577' ' ' HIS . . . . . 0.773 ' O ' HG12 ' B' ' 580' ' ' VAL . 10.7 t60 -60.2 128.02 34.72 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.418 0.628 . . . . 2.8500000000000001 112.545 -175.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 578' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -44.83 125.87 5.32 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.38 -0.827 . . . . 2.1499999999999999 113.135 -171.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.23 -34.74 4.75 Favored Glycine 0 C--O 1.223 -0.57 0 N-CA-C 116.254 1.262 . . . . 0.0 116.254 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 580' ' ' VAL . . . . . 0.773 HG12 ' O ' ' B' ' 577' ' ' HIS . 13.6 p -53.82 -46.34 63.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 113.121 0.785 . . . . 1.29 113.121 -175.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.524 ' N ' HG13 ' B' ' 580' ' ' VAL . 0.7 OUTLIER -59.67 -42.21 92.37 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.406 0.521 . . . . 1.99 112.406 -179.852 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 582' ' ' ASP . . . . . 0.494 ' HA ' ' OE1' ' B' ' 629' ' ' GLN . 19.3 t70 -60.54 -42.5 96.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.149 0.425 . . . . 2.23 112.149 172.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 31.8 mmt -60.66 -49.49 77.29 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 121.109 -0.236 . . . . 2.5800000000000001 110.439 175.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.87 -42.87 80.54 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.176 -0.465 . . . . 0.029999999999999999 111.74 -177.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 585' ' ' CYS . . . . . . . . . . . . . 44.4 t -74.43 -40.92 61.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 120.009 -0.676 . . . . 1.5 111.957 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 586' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -59.58 -46.31 89.3 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.306 -0.406 . . . . 1.98 111.95 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 587' ' ' THR . . . . . . . . . . . . . 41.0 m -62.15 -41.25 98.11 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.329 0.652 . . . . 1.3 110.413 175.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 588' ' ' PHE . . . . . 0.443 ' HB2' HD23 ' B' ' 569' ' ' LEU . 87.0 t80 -61.52 -32.15 72.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.007 -0.542 . . . . 0.53000000000000003 111.125 -177.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 589' ' ' ILE . . . . . . . . . . . . . 47.4 mm -79.86 -36.0 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 C-N-CA 116.871 -1.932 . . . . 1.97 109.8 -175.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -57.44 -50.01 74.39 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 107.713 -1.218 . . . . 2.6200000000000001 107.713 176.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 98.2 mt -63.82 -43.82 98.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 112.786 0.661 . . . . 1.96 112.786 -177.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.83 -39.14 93.52 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 177.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -62.32 -70.14 0.22 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 119.155 -1.018 . . . . 2.3599999999999999 109.772 174.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 594' ' ' LYS . . . . . 0.568 ' HG2' ' HG3' ' B' ' 552' ' ' PRO . 2.3 mppt? -56.11 -23.84 36.81 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.562 2.06 . . . . 2.1899999999999999 116.562 -176.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 83.6 m -121.67 25.22 9.4 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.263 1.209 . . . . 1.26 114.263 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 596' ' ' ARG . . . . . 0.517 ' HA ' ' CE2' ' B' ' 599' ' ' PHE . 34.4 ptt180 -48.52 -38.54 20.57 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 115.83 1.789 . . . . 3.5800000000000001 115.83 -172.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . . . . . . . . . 68.7 mtm180 -69.52 -32.61 71.56 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 113.214 0.82 . . . . 3.7400000000000002 113.214 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 598' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -3.81 18.68 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.577 -0.738 . . . . 2.1400000000000001 112.052 -173.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 599' ' ' PHE . . . . . 0.524 ' C ' ' HD1' ' B' ' 599' ' ' PHE . 0.1 OUTLIER -105.62 -16.89 14.57 Favored 'General case' 0 CA--C 1.517 -0.32 0 O-C-N 123.621 0.576 . . . . 2.9500000000000002 110.158 -176.552 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . 0.46 ' N ' ' HD1' ' B' ' 599' ' ' PHE . 9.4 p -105.82 -24.33 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 115.162 -0.926 . . . . 1.4199999999999999 111.327 -175.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -102.04 139.52 37.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 119.551 -0.86 . . . . 2.3399999999999999 111.596 176.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 3.9 p -60.89 122.74 12.14 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 N-CA-C 108.597 -0.89 . . . . 1.3700000000000001 108.597 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -92.76 167.3 11.97 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 123.675 0.609 . . . . 2.6800000000000002 110.086 -177.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 7.4 p -71.94 129.01 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 N-CA-C 112.927 0.714 . . . . 1.27 112.927 -175.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.31 6.53 64.51 Favored Glycine 0 N--CA 1.446 -0.7 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.111 -175.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 606' ' ' GLU . . . . . 0.523 ' HG3' ' H ' ' B' ' 608' ' ' MET . 8.3 tp10 -131.5 158.0 42.04 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.557 -0.857 . . . . 2.5099999999999998 110.746 175.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 16.7 t -103.27 -22.55 4.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.032 -0.985 . . . . 1.3999999999999999 112.451 -175.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 608' ' ' MET . . . . . 0.523 ' H ' ' HG3' ' B' ' 606' ' ' GLU . 88.2 mtp -136.95 142.28 37.94 Favored Pre-proline 0 C--O 1.224 -0.268 0 N-CA-C 112.672 0.619 . . . . 2.6800000000000002 112.672 -174.281 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 609' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -52.08 130.88 36.86 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 120.869 1.046 . . . . 0.42999999999999999 112.131 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -57.02 -31.76 65.46 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 111.826 0.306 . . . . 2.3700000000000001 111.826 -174.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 611' ' ' ILE . . . . . 0.518 HG12 ' O ' ' B' ' 599' ' ' PHE . 6.4 pt -50.05 -44.87 22.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 120.784 0.326 . . . . 1.8400000000000001 110.513 178.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 612' ' ' ASP . . . . . 0.436 ' H ' HG13 ' B' ' 611' ' ' ILE . 24.8 m-20 -49.94 -52.01 36.69 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.621 0.769 . . . . 2.1499999999999999 112.844 177.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -59.94 -37.14 78.65 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 120.613 -0.435 . . . . 2.6600000000000001 110.175 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 65.2 mt -64.51 -48.02 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.214 -0.594 . . . . 1.76 111.961 178.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 615' ' ' LEU . . . . . 0.597 HD13 HD11 ' B' ' 618' ' ' ILE . 4.5 mm? -62.63 -31.11 71.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.958 0.725 . . . . 1.8400000000000001 112.958 -177.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -79.54 2.14 23.3 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.662 1.356 . . . . 2.0600000000000001 114.662 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 617' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -142.42 15.61 2.02 Favored 'General case' 0 C--O 1.243 0.72 0 N-CA-C 113.152 0.797 . . . . 1.97 113.152 -174.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 618' ' ' ILE . . . . . 0.597 HD11 HD13 ' B' ' 615' ' ' LEU . 72.0 mt -46.83 -47.14 8.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 118.997 -1.081 . . . . 2.0099999999999998 110.176 -176.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 619' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -63.09 -51.14 67.79 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.744 1.016 . . . . 2.2799999999999998 113.744 -176.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 620' ' ' THR . . . . . . . . . . . . . 32.6 m -56.92 -31.87 65.38 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 119.487 -0.885 . . . . 1.3200000000000001 110.743 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 621' ' ' ILE . . . . . . . . . . . . . 64.6 mt -79.32 -42.7 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 115.334 1.605 . . . . 2.0 115.334 -178.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 622' ' ' ILE . . . . . 0.4 HG12 ' O ' ' B' ' 618' ' ' ILE . 47.2 pt -87.5 -6.48 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 115.059 1.503 . . . . 2.0899999999999999 115.059 -177.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 8.7 p -19.91 -58.3 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 116.575 2.065 . . . . 1.47 116.575 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -99.26 -7.57 26.23 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 114.045 -1.434 . . . . 2.0699999999999998 111.043 -163.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 625' ' ' LEU . . . . . . . . . . . . . 96.0 mt -71.93 146.9 47.51 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 123.286 0.366 . . . . 1.6699999999999999 111.601 -173.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 626' ' ' GLN . . . . . 0.438 ' O ' HG23 ' B' ' 630' ' ' VAL . 1.7 mp0 -76.74 162.09 71.7 Favored Pre-proline 0 CA--C 1.52 -0.191 0 N-CA-C 108.835 -0.802 . . . . 2.3500000000000001 108.835 174.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 627' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -47.85 -43.58 29.09 Favored 'Trans proline' 0 C--O 1.233 0.256 0 N-CA-C 115.765 1.409 . . . . 0.44 115.765 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 628' ' ' GLN . . . . . 0.582 ' HG3' HE21 ' B' ' 629' ' ' GLN . 20.9 pt20 -67.33 -42.98 82.67 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.637 -0.505 . . . . 2.6200000000000001 109.637 -174.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 629' ' ' GLN . . . . . 0.582 HE21 ' HG3' ' B' ' 628' ' ' GLN . 29.1 mm-40 -63.31 -38.23 90.35 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.924 -0.58 . . . . 2.0600000000000001 110.924 178.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 630' ' ' VAL . . . . . 0.438 HG23 ' O ' ' B' ' 626' ' ' GLN . 95.1 t . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.315 -0.85 . . . . 1.3 110.685 176.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 112.36 -0.296 . . . . 9.8599999999999994 112.36 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.8 m -135.91 38.42 2.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.837 0.351 . . . . 8.7799999999999994 110.875 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 58.76 27.45 16.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.08 -0.509 . . . . 6.8200000000000003 111.237 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.5 t -96.24 137.97 34.54 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.186 -0.461 . . . . 6.25 111.189 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 103.06 116.76 4.24 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.94 -0.648 . . . . 4.1200000000000001 112.599 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -149.59 -49.03 0.14 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.651 0.262 . . . . 4.0300000000000002 110.711 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.661 HD21 ' HE2' ' B' ' 514' ' ' LYS . 3.9 mm? -55.56 -30.43 60.77 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.387 -0.37 . . . . 2.21 110.991 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -62.06 -34.77 76.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.299 -0.41 . . . . 3.79 110.906 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -76.6 -33.12 58.44 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.179 -0.464 . . . . 4.1699999999999999 110.872 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.78 HD21 HG23 ' B' ' 518' ' ' VAL . 10.4 mp -56.5 -35.38 67.94 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.997 0.427 . . . . 2.5800000000000001 110.633 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.97 -34.36 38.73 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.012 -0.54 . . . . 2.8399999999999999 110.809 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.4 tp -69.33 -19.71 63.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.923 -0.581 . . . . 3.6699999999999999 110.413 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 52.0 tptt -80.35 -21.11 42.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.93 -0.577 . . . . 4.9299999999999997 111.068 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.514 HD21 ' HD3' ' B' ' 568' ' ' LYS . 0.7 OUTLIER -66.49 -10.36 43.74 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.36 -0.382 . . . . 3.27 110.587 -179.875 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.24 -30.02 25.59 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.236 -0.438 . . . . 3.1299999999999999 111.231 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -84.18 -113.52 0.63 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.721 -0.752 . . . . 2.4700000000000002 112.226 179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.441 HD12 ' SG ' ' B' ' 528' ' ' CYS . 38.0 tp 55.41 81.25 0.12 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.98 0.419 . . . . 2.1400000000000001 110.853 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -81.98 142.76 32.11 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.1 -0.5 . . . . 3.9199999999999999 111.058 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 8.9 tp -172.62 -22.68 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 3.25 110.591 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -127.82 117.15 21.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.055 -0.521 . . . . 5.9500000000000002 110.887 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.4 ttpp 63.24 113.81 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.988 -0.551 . . . . 9.3900000000000006 111.495 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.9 m -120.41 126.44 50.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.06 -0.518 . . . . 8.9700000000000006 110.867 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -91.7 -22.71 20.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.294 -0.412 . . . . 11.67 111.003 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 80.21 -112.89 3.53 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.701 -0.761 . . . . 12.859999999999999 112.276 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 55.44 75.01 0.34 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.911 0.386 . . . . 15.369999999999999 110.893 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -73.65 101.12 3.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.068 -0.514 . . . . 16.539999999999999 110.852 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 21.6 p . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.085 -0.959 . . . . 17.93 111.681 179.93 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 504' ' ' ILE . . . . . . . . . . . . . 44.7 pt . . . . . 0 C--O 1.237 0.419 0 N-CA-C 113.015 0.746 . . . . 2.1299999999999999 113.015 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 505' ' ' SER . . . . . . . . . . . . . 78.4 p -48.83 119.11 2.94 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.519 0.563 . . . . 1.29 112.519 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 506' ' ' GLY . . . . . . . . . . . . . . . 92.76 1.53 67.92 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 120.961 -0.638 . . . . 0.0 114.436 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 507' ' ' ALA . . . . . . . . . . . . . . . -94.39 -7.52 41.35 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 117.685 0.742 . . . . 0.02 112.434 176.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 508' ' ' MET . . . . . . . . . . . . . 67.5 mtt -112.45 159.97 18.22 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.116 0.484 . . . . 2.21 112.263 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 509' ' ' HIS . . . . . . . . . . . . . 72.8 m80 -69.73 134.28 48.45 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 109.042 -0.725 . . . . 2.6699999999999999 109.042 174.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 510' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -41.73 -35.32 0.76 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.409 0.892 . . . . 2.6600000000000001 113.409 -173.255 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 511' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -73.88 -41.88 61.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.598 -0.728 . . . . 2.4399999999999999 112.097 -176.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 512' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -64.85 -40.18 94.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.184 0.516 . . . . 2.0800000000000001 110.823 171.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 513' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -53.61 -48.67 69.07 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.347 -0.842 . . . . 1.9199999999999999 111.199 177.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 514' ' ' LYS . . . . . 0.661 ' HE2' HD21 ' A' ' 7' ' ' LEU . 50.4 tttm -54.91 -57.53 11.24 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 111.912 0.338 . . . . 2.73 111.912 179.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 515' ' ' ARG . . . . . 0.4 ' O ' HG23 ' B' ' 519' ' ' THR . 57.1 ttp180 -56.71 -35.92 69.07 Favored 'General case' 0 CA--C 1.505 -0.773 0 O-C-N 124.16 0.913 . . . . 3.75 111.037 -177.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.515 ' O ' HG23 ' B' ' 520' ' ' VAL . 86.1 t80 -76.12 -45.52 33.33 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.191 -0.913 . . . . 1.8899999999999999 110.539 -173.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 517' ' ' LEU . . . . . 0.568 ' O ' HG22 ' B' ' 521' ' ' ILE . 0.2 OUTLIER -66.8 -32.2 73.33 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.738 -0.665 . . . . 1.8999999999999999 112.658 177.104 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 518' ' ' VAL . . . . . 0.78 HG23 HD21 ' A' ' 10' ' ' LEU . 3.2 p -67.49 -35.14 72.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 118.483 -1.287 . . . . 1.3999999999999999 109.031 178.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 519' ' ' THR . . . . . 0.4 HG23 ' O ' ' B' ' 515' ' ' ARG . 76.3 p -73.02 -36.3 66.94 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.348 0.594 . . . . 1.1799999999999999 112.401 178.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 520' ' ' VAL . . . . . 0.515 HG23 ' O ' ' B' ' 516' ' ' PHE . 55.5 t -71.25 -42.24 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 O-C-N 122.162 -0.336 . . . . 1.22 111.702 -174.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 521' ' ' ILE . . . . . 0.568 HG22 ' O ' ' B' ' 517' ' ' LEU . 13.5 tt -90.73 -25.83 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 115.42 1.637 . . . . 1.98 115.42 -175.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 522' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -60.77 -35.19 75.81 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.712 -0.847 . . . . 2.5699999999999998 108.712 173.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 523' ' ' ASP . . . . . 0.419 ' O ' HD23 ' B' ' 527' ' ' LEU . 22.0 m-20 -92.5 -21.44 20.14 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 115.001 1.482 . . . . 2.1699999999999999 115.001 -177.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 524' ' ' LEU . . . . . . . . . . . . . 70.1 mt -70.69 -45.27 65.33 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.314 -0.624 . . . . 1.48 109.314 168.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 525' ' ' LEU . . . . . . . . . . . . . 70.1 mt -52.32 -45.42 65.59 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.315 0.579 . . . . 1.95 110.962 169.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -66.47 -40.53 94.38 Favored Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . 0.419 HD23 ' O ' ' B' ' 523' ' ' ASP . 2.6 mm? -63.63 -36.14 82.83 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.036 0.446 . . . . 1.6699999999999999 111.426 175.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 528' ' ' CYS . . . . . 0.441 ' SG ' HD12 ' A' ' 17' ' ' LEU . 40.2 t -63.54 -47.68 80.61 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.023 -0.535 . . . . 0.58999999999999997 110.699 -175.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 529' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.67 -29.6 70.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.485 -0.78 . . . . 2.5 112.566 173.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 530' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -71.78 -54.68 9.42 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.283 0.846 . . . . 2.2400000000000002 113.283 -177.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 531' ' ' LYS . . . . . 0.563 ' HD2' HD11 ' B' ' 540' ' ' ILE . 80.0 mttt -68.73 137.89 54.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.065 -0.516 . . . . 2.2799999999999998 111.047 -177.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 532' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -96.42 160.63 14.31 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.837 -0.619 . . . . 4.21 110.158 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 533' ' ' GLY . . . . . . . . . . . . . . . 87.47 119.58 1.35 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.848 -0.614 . . . . 0.0 114.022 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 534' ' ' LYS . . . . . . . . . . . . . 9.9 ptpp? -47.02 -36.66 8.14 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.259 0.837 . . . . 2.9500000000000002 113.259 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 535' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -50.56 -51.85 44.32 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.373 -0.531 . . . . 2.2000000000000002 110.809 174.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 536' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.06 -44.83 83.37 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.62 0.6 . . . . 1.47 112.62 178.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 537' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -67.87 -31.9 72.03 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.451 -0.499 . . . . 2.5 110.272 -174.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . 0.407 ' HB2' ' CD2' ' B' ' 577' ' ' HIS . . . -68.21 -47.0 69.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.862 -0.608 . . . . 0.040000000000000001 111.048 178.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 539' ' ' ILE . . . . . . . . . . . . . 48.4 mm -58.12 -54.98 25.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 121.549 0.69 . . . . 1.8200000000000001 111.234 173.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 540' ' ' ILE . . . . . 0.563 HD11 ' HD2' ' B' ' 531' ' ' LYS . 80.7 mt -56.75 -48.14 81.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 121.698 -0.626 . . . . 1.8500000000000001 110.59 -178.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 541' ' ' ALA . . . . . . . . . . . . . . . -57.46 -44.09 84.52 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 113.595 0.961 . . . . 0.02 113.595 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 542' ' ' SER . . . . . . . . . . . . . 62.3 m -60.42 -38.81 85.23 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 120.545 -0.462 . . . . 1.2 110.306 -178.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 543' ' ' ASN . . . . . . . . . . . . . 40.5 t-20 -68.92 -47.12 66.54 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 114.365 1.246 . . . . 2.0299999999999998 114.365 -175.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 544' ' ' ILE . . . . . 0.411 HG23 HG13 ' B' ' 521' ' ' ILE . 95.1 mt -52.6 -46.06 48.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 108.424 -0.954 . . . . 1.8100000000000001 108.424 170.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 545' ' ' MET . . . . . 0.754 ' HB3' HG21 ' B' ' 587' ' ' THR . 45.3 mtp -63.97 -42.33 97.28 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.78 -0.768 . . . . 2.6000000000000001 112.818 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 546' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -58.35 -48.71 79.7 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 119.145 -1.022 . . . . 2.0800000000000001 109.932 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 80.8 mt -55.07 -61.42 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 N-CA-C 112.8 0.667 . . . . 1.5 112.8 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 548' ' ' VAL . . . . . 0.441 HG22 ' HA ' ' B' ' 545' ' ' MET . 33.8 m -47.42 -44.17 9.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.812 -0.755 . . . . 1.3999999999999999 111.427 176.265 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 549' ' ' GLY . . . . . 0.496 ' HA2' HD11 ' B' ' 591' ' ' ILE . . . -57.41 -28.08 58.9 Favored Glycine 0 C--N 1.332 0.309 0 O-C-N 121.853 -0.529 . . . . 0.0 112.917 -177.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 550' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -86.99 -9.57 55.26 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.614 0.598 . . . . 2.27 112.614 -175.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 551' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -120.43 59.74 7.13 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 113.781 1.03 . . . . 3.5299999999999998 113.781 -176.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 552' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.03 -39.36 91.69 Favored 'Trans proline' 0 CA--C 1.531 0.334 0 O-C-N 122.071 0.511 . . . . 0.46000000000000002 113.134 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 553' ' ' ARG . . . . . . . . . . . . . 9.9 mmm180 -56.23 -46.78 79.4 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 121.169 0.509 . . . . 3.8700000000000001 109.974 -174.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 554' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -48.9 -59.84 3.25 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 123.89 0.876 . . . . 0.69999999999999996 112.101 167.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 555' ' ' LEU . . . . . . . . . . . . . 11.2 mp -54.26 -48.56 71.05 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 116.267 -0.424 . . . . 1.49 110.202 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 556' ' ' ARG . . . . . 0.484 ' HG3' ' NE2' ' B' ' 598' ' ' HIS . 78.6 ttt180 -53.93 -35.87 62.16 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 113.827 1.047 . . . . 3.0899999999999999 113.827 -178.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 557' ' ' ALA . . . . . . . . . . . . . . . -86.06 -12.17 50.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.517 -0.473 . . . . 0.0 112.102 -177.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 558' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -128.23 78.5 1.84 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.388 1.255 . . . . 2.9300000000000002 114.388 -177.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 559' ' ' TRP . . . . . . . . . . . . . 33.4 p90 -50.51 -48.28 57.06 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 116.57 2.063 . . . . 3.1099999999999999 116.57 -176.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 560' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -56.57 -36.68 69.62 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.23 -0.441 . . . . 3.3199999999999998 111.136 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 561' ' ' PHE . . . . . 0.489 ' O ' HG23 ' B' ' 565' ' ' VAL . 3.5 t80 -74.89 -45.08 45.24 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.092 -1.043 . . . . 1.25 111.978 175.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 562' ' ' LEU . . . . . 0.419 ' O ' HG23 ' B' ' 566' ' ' VAL . 2.9 tt -49.99 -59.13 4.18 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 122.403 0.281 . . . . 1.3200000000000001 110.34 175.004 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 563' ' ' LYS . . . . . 0.493 ' NZ ' HD21 ' B' ' 567' ' ' ASN . 0.2 OUTLIER -50.14 -38.63 40.18 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.922 1.082 . . . . 2.7400000000000002 113.922 178.802 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 564' ' ' THR . . . . . . . . . . . . . 20.1 p -71.89 -39.31 69.66 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.732 -0.667 . . . . 1.24 110.356 -176.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 565' ' ' VAL . . . . . 0.489 HG23 ' O ' ' B' ' 561' ' ' PHE . 68.5 t -62.81 -41.31 92.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.685 -0.689 . . . . 1.1899999999999999 112.542 173.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 566' ' ' VAL . . . . . 0.562 HG21 ' HZ ' ' B' ' 599' ' ' PHE . 58.1 t -71.0 -50.93 39.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.542 -0.463 . . . . 1.3600000000000001 110.844 -176.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 567' ' ' ASN . . . . . 0.493 HD21 ' NZ ' ' B' ' 563' ' ' LYS . 91.1 m-20 -51.08 -37.37 45.32 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.996 -0.547 . . . . 1.9399999999999999 112.012 170.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 568' ' ' LYS . . . . . 0.514 ' HD3' HD21 ' A' ' 14' ' ' LEU . 29.2 ttpt -72.67 -32.6 65.94 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.753 -0.462 . . . . 3.5299999999999998 109.753 -179.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 569' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' B' ' 573' ' ' MET . 4.2 mp -67.46 -36.5 81.28 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.73 -0.841 . . . . 2.0099999999999998 108.73 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 570' ' ' PHE . . . . . 0.516 ' HD1' HG13 ' B' ' 621' ' ' ILE . 0.0 OUTLIER -65.38 -39.38 92.17 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.872 -0.418 . . . . 3.77 109.872 178.372 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -57.66 -53.45 58.06 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 119.999 -0.68 . . . . 2.4700000000000002 110.545 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 572' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -62.56 -9.86 10.16 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 114.079 1.14 . . . . 1.23 114.079 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 573' ' ' MET . . . . . 0.924 ' HB3' HD11 ' B' ' 625' ' ' LEU . 64.0 mtt -76.42 -5.35 46.93 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.639 0.733 . . . . 2.1099999999999999 109.662 178.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 574' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -109.4 -0.48 18.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.755 -1.112 . . . . 3.2000000000000002 111.428 173.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 575' ' ' GLU . . . . . 0.445 ' HG2' HG11 ' B' ' 580' ' ' VAL . 14.4 tp10 -68.48 130.2 42.17 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.214 -0.448 . . . . 1.55 110.079 177.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 576' ' ' THR . . . . . . . . . . . . . 7.2 m -87.87 -21.24 25.1 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.042 0.756 . . . . 1.3999999999999999 113.042 -177.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 577' ' ' HIS . . . . . 0.576 ' HD1' ' H ' ' B' ' 578' ' ' ASP . 0.8 OUTLIER -60.22 128.03 34.75 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.411 0.624 . . . . 2.8500000000000001 112.596 -175.4 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 578' ' ' ASP . . . . . 0.576 ' H ' ' HD1' ' B' ' 577' ' ' HIS . 7.1 m-20 -44.88 125.88 5.38 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.388 -0.824 . . . . 2.1499999999999999 113.063 -171.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 579' ' ' GLY . . . . . . . . . . . . . . . 96.26 -34.75 4.75 Favored Glycine 0 C--O 1.222 -0.627 0 N-CA-C 116.29 1.276 . . . . 0.0 116.29 174.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 580' ' ' VAL . . . . . 0.445 HG11 ' HG2' ' B' ' 575' ' ' GLU . 58.1 t -53.68 -46.42 61.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 113.146 0.795 . . . . 1.29 113.146 -175.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -59.6 -42.31 92.29 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.383 0.512 . . . . 1.99 112.383 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -60.54 -42.42 96.46 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.213 0.449 . . . . 2.23 112.213 172.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 583' ' ' MET . . . . . . . . . . . . . 25.7 mmt -60.71 -49.48 77.32 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 121.058 -0.257 . . . . 2.5800000000000001 110.447 175.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 584' ' ' ALA . . . . . . . . . . . . . . . -56.86 -42.83 80.46 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.159 -0.473 . . . . 0.029999999999999999 111.79 -177.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 585' ' ' CYS . . . . . 0.464 ' SG ' ' HG3' ' B' ' 629' ' ' GLN . 23.6 p -74.4 -40.92 61.73 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 119.957 -0.697 . . . . 1.5 111.984 -177.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 586' ' ' ASP . . . . . 0.489 ' O ' HG12 ' B' ' 589' ' ' ILE . 18.0 t70 -59.53 -46.38 89.04 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.273 -0.421 . . . . 1.98 111.92 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 587' ' ' THR . . . . . 0.754 HG21 ' HB3' ' B' ' 545' ' ' MET . 40.4 p -62.19 -41.18 98.1 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 123.327 0.651 . . . . 1.3 110.43 175.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 588' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -61.55 -32.14 72.2 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.035 -0.53 . . . . 0.53000000000000003 111.153 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 589' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 586' ' ' ASP . 41.5 pt -79.94 -35.85 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 C-N-CA 116.871 -1.932 . . . . 1.97 109.76 -175.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 590' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -57.52 -50.04 74.38 Favored 'General case' 0 C--O 1.221 -0.438 0 N-CA-C 107.701 -1.222 . . . . 2.6200000000000001 107.701 176.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . 0.496 HD11 ' HA2' ' B' ' 549' ' ' GLY . 1.7 mp -63.77 -43.74 98.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.689 -0.687 . . . . 1.96 112.815 -176.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 592' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.04 93.23 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.392 -0.523 . . . . 0.0 112.301 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 593' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -62.4 -70.06 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 119.112 -1.035 . . . . 2.3599999999999999 109.793 174.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 594' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -56.09 -23.84 36.41 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 116.608 2.077 . . . . 2.1899999999999999 116.608 -176.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 595' ' ' CYS . . . . . . . . . . . . . 1.1 p -121.68 25.25 9.38 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 114.201 1.186 . . . . 1.26 114.201 -178.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 596' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -48.46 -38.6 20.37 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 115.825 1.787 . . . . 3.5800000000000001 115.825 -172.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 597' ' ' ARG . . . . . 0.421 ' O ' HG12 ' B' ' 600' ' ' VAL . 54.8 mtp180 -69.54 -32.63 71.55 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.201 0.815 . . . . 3.7400000000000002 113.201 -175.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 598' ' ' HIS . . . . . 0.484 ' NE2' ' HG3' ' B' ' 556' ' ' ARG . 61.9 m-70 -70.2 -3.77 18.51 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.603 -0.726 . . . . 2.1400000000000001 112.05 -173.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 599' ' ' PHE . . . . . 0.562 ' HZ ' HG21 ' B' ' 566' ' ' VAL . 3.2 m-85 -105.52 -16.95 14.57 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 123.597 0.561 . . . . 2.9500000000000002 110.257 -176.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . 0.421 HG12 ' O ' ' B' ' 597' ' ' ARG . 15.0 p -105.76 -24.38 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.091 -0.959 . . . . 1.4199999999999999 111.319 -175.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 601' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -102.03 139.51 37.56 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 119.578 -0.849 . . . . 2.3399999999999999 111.55 176.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 602' ' ' VAL . . . . . . . . . . . . . 16.1 m -60.89 122.71 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 108.611 -0.885 . . . . 1.3700000000000001 108.611 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 603' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -92.78 167.29 11.96 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 123.648 0.592 . . . . 2.6800000000000002 110.06 -177.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 604' ' ' VAL . . . . . . . . . . . . . 42.9 t -71.93 128.93 35.43 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 N-CA-C 112.971 0.73 . . . . 1.27 112.971 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 605' ' ' GLY . . . . . . . . . . . . . . . 92.38 6.53 64.38 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.062 -175.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 606' ' ' GLU . . . . . 0.509 ' HG2' ' H ' ' B' ' 608' ' ' MET . 34.7 tt0 -131.49 158.01 42.03 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.626 -0.83 . . . . 2.5099999999999998 110.756 175.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 607' ' ' VAL . . . . . . . . . . . . . 19.1 t -103.28 -22.55 4.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.055 -0.975 . . . . 1.3999999999999999 112.451 -175.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 608' ' ' MET . . . . . 0.509 ' H ' ' HG2' ' B' ' 606' ' ' GLU . 96.4 mmm -136.96 142.21 37.67 Favored Pre-proline 0 C--O 1.222 -0.343 0 N-CA-C 112.615 0.598 . . . . 2.6800000000000002 112.615 -174.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 609' ' ' PRO . . . . . 0.55 ' HB2' HG22 ' B' ' 611' ' ' ILE . 10.3 Cg_endo -52.13 130.85 36.91 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 120.83 1.02 . . . . 0.42999999999999999 112.162 179.224 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -56.9 -31.85 65.3 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.866 0.321 . . . . 2.3700000000000001 111.866 -174.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 611' ' ' ILE . . . . . 0.55 HG22 ' HB2' ' B' ' 609' ' ' PRO . 6.7 tp -50.0 -44.88 22.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 CA-C-O 120.787 0.327 . . . . 1.8400000000000001 110.555 178.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 612' ' ' ASP . . . . . 0.448 ' OD1' ' HG2' ' B' ' 609' ' ' PRO . 0.9 OUTLIER -49.86 -52.0 36.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.612 0.765 . . . . 2.1499999999999999 112.875 177.698 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 613' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -59.95 -37.13 78.67 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 120.606 -0.438 . . . . 2.6600000000000001 110.175 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 614' ' ' ILE . . . . . . . . . . . . . 62.7 mt -64.55 -47.96 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.97 0 C-N-CA 120.117 -0.633 . . . . 1.76 111.968 178.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 615' ' ' LEU . . . . . 0.469 HD12 HD11 ' B' ' 618' ' ' ILE . 57.2 tp -62.6 -31.13 71.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.955 0.724 . . . . 1.8400000000000001 112.955 -177.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 616' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -79.57 2.11 23.46 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.599 1.333 . . . . 2.0600000000000001 114.599 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 617' ' ' ASN . . . . . 0.528 ' HB3' HG22 ' B' ' 620' ' ' THR . 12.3 m120 -142.48 15.79 2.01 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 113.104 0.779 . . . . 1.97 113.104 -174.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 618' ' ' ILE . . . . . 0.469 HD11 HD12 ' B' ' 615' ' ' LEU . 81.0 mt -46.93 -47.06 8.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 C-N-CA 118.929 -1.109 . . . . 2.0099999999999998 110.177 -176.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 619' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -63.19 -51.1 67.7 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 113.703 1.001 . . . . 2.2799999999999998 113.703 -176.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 620' ' ' THR . . . . . 0.528 HG22 ' HB3' ' B' ' 617' ' ' ASN . 8.8 t -56.94 -31.82 65.35 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.46 -0.896 . . . . 1.3200000000000001 110.741 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 621' ' ' ILE . . . . . 0.516 HG13 ' HD1' ' B' ' 570' ' ' PHE . 15.7 tt -79.36 -42.67 23.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 N-CA-C 115.267 1.58 . . . . 2.0 115.267 -178.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 622' ' ' ILE . . . . . 0.829 ' HA ' HD13 ' B' ' 625' ' ' LEU . 0.2 OUTLIER -87.7 -6.27 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 115.011 1.485 . . . . 2.0899999999999999 115.011 -177.586 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 623' ' ' CYS . . . . . . . . . . . . . 52.7 t -20.05 -58.28 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 116.538 2.051 . . . . 1.47 116.538 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 624' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -99.33 -7.53 26.16 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.061 -1.427 . . . . 2.0699999999999998 111.007 -163.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 625' ' ' LEU . . . . . 0.924 HD11 ' HB3' ' B' ' 573' ' ' MET . 9.0 mp -71.87 146.85 47.64 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 123.326 0.391 . . . . 1.6699999999999999 111.769 -173.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 626' ' ' GLN . . . . . 0.504 ' O ' HG23 ' B' ' 630' ' ' VAL . 11.8 pt20 -76.69 162.08 71.8 Favored Pre-proline 0 CA--C 1.519 -0.22 0 N-CA-C 108.843 -0.799 . . . . 2.3500000000000001 108.843 174.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 627' ' ' PRO . . . . . 0.405 ' HD2' ' HB2' ' B' ' 626' ' ' GLN . 85.2 Cg_exo -47.86 -43.63 29.0 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 N-CA-C 115.792 1.42 . . . . 0.44 115.792 -178.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 628' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -67.29 -43.07 82.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.573 -0.528 . . . . 2.6200000000000001 109.573 -174.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 629' ' ' GLN . . . . . 0.464 ' HG3' ' SG ' ' B' ' 585' ' ' CYS . 1.1 mp0 -63.18 -38.37 90.89 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.934 -0.575 . . . . 2.0600000000000001 110.928 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 630' ' ' VAL . . . . . 0.517 HG22 HG12 ' B' ' 622' ' ' ILE . 59.8 t . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.207 -0.901 . . . . 1.3 110.687 176.805 . . . . . . . . 1 1 . 1 stop_ save_